Gaussian 16 GINC-BERON207 GRUFOR coments ES64L-G16RevC.02 17-Dec-2024 Gaussian 16 7-Dec-2021 ES64L-G16RevC.02 43 43 (5D, 7F) def2SVP UwB97XD def2SVP FOpt #p wB97xD/Def2SVP opt freq SCF=(XQC) gfprint gfinput nosymm 301.02579999999995 0 2 AuxInfo=1/0/N:9,16,8,17,10,15,23,24,5,4,1,6,7,22,3,11,18,29,27,2;32,36,40,31/E:(1,2)(3,4)(5,6)(7,8)(9,10)(12,13)(16,17)(18,19);(1,2,3)/CRV:1.3,2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,16.2,17.2,20.1;/rA:43nC3O1BC3C3C3C3C3C3C3N2HHHC3C3C3N2HHHC3C3C3HHNHNHNCHHHCHHHCHHH/rB:s1;;s1;s1;s3s5;s3s4;s5;s8;s9;s6s10;s8;s9;s10;;s15;s4s16;s7s15;s17;s15;s16;s3;;s23;s23;s24;s22s24;s27;s22s23;s29;;s31;s32;s32;s32;s31;s36;s36;s36;s31;s40;s40;s40;/rC:-2.723,.277,-.0604;-3.8939,.4547,.2794;.0817,-.1485,-.8881;-2.1616,-1.1013,-.1633;-1.8348,1.4366,-.3639;-.4881,1.268,-.7692;-.8219,-1.3413,-.5567;-2.3478,2.7324,-.2322;-1.5231,3.8141,-.4976;-.1992,3.5614,-.8885;.3089,2.348,-1.0233;-3.3871,2.8547,.0809;-1.8806,4.8409,-.4057;.4745,4.4002,-1.0987;-1.1185,-3.6223,-.3019;-2.4587,-3.471,.0859;-2.9816,-2.1895,.1566;-.324,-2.6118,-.6119;-4.0136,-1.9967,.4582;-.6794,-4.6251,-.3576;-3.0613,-4.3479,.3278;1.5616,-.3684,-1.231;3.5385,-1.3482,-1.5584;3.7172,.0013,-1.6699;4.2514,-2.1614,-1.6488;4.6134,.5773,-1.8768;2.487,.5797,-1.4691;2.175,1.5612,-1.4467;2.2053,-1.5489,-1.294;1.6489,-2.3978,-1.1118;1.7536,.3171,2.9352;2.735,-.6008,2.4136;3.7455,-.1749,2.5169;2.7102,-1.5464,2.9775;2.5805,-.8483,1.3381;.4166,-.2315,2.9134;.3911,-1.1854,3.4623;-.2842,.4589,3.4072;.0366,-.4213,1.8858;1.8307,1.6152,2.3076;1.0923,2.2972,2.7561;2.8298,2.0526,2.4644;1.637,1.5884,1.2131; /NFS_R1/Userdata/grufor/SOFTWARE/g16/g16 Output=18_a_TMA_2.log chk=18_a_TMA_2.chk Mem=12000MB NProc=12 #p wB97xD/Def2SVP opt freq SCF=(XQC) gfprint gfinput nosymm 1/18=20,19=15,26=3,38=1/1,3 2/9=110,12=2,15=1,17=6,18=5,40=1/2 3/5=43,7=101,11=2,24=110,25=1,30=1,71=1,74=-58/1,2,3 4//1 5/5=2,8=3,13=1,38=5/2,8 6/7=2,8=2,9=2,10=2,28=1/1 7/30=1/1,2,3,16 1/18=20,19=15,26=3/3(2) 2/9=110,15=1/2 99//99 2/9=110,15=1/2 3/5=43,7=101,11=2,25=1,30=1,71=1,74=-58/1,2,3 4/5=5,16=3,69=1/1 5/5=2,8=3,13=1,38=5/2,8 7/30=1/1,2,3,16 1/18=20,19=15,26=3/3(-5) 2/9=110,15=1/2 6/7=2,8=2,9=2,10=2,19=2,28=1/1 99/9=1/99 coments 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 12 16 11 12 12 12 12 12 12 12 14 1 1 1 12 12 12 14 1 1 1 12 12 12 1 1 14 1 14 1 14 12 1 1 1 12 1 1 1 12 1 1 1 12.0000000 15.9949146 11.0093053 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 14.0030740 1.0078250 1.0078250 1.0078250 12.0000000 12.0000000 12.0000000 14.0030740 1.0078250 1.0078250 1.0078250 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 14.0030740 1.0078250 14.0030740 1.0078250 14.0030740 12.0000000 1.0078250 1.0078250 1.0078250 12.0000000 1.0078250 1.0078250 1.0078250 12.0000000 1.0078250 1.0078250 1.0078250 0 0 3 0 0 0 0 0 0 0 2 1 1 1 0 0 0 2 1 1 1 0 0 0 1 1 2 1 2 1 2 0 1 1 1 0 1 1 1 0 1 1 1 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 (Enter /NFS_R1/Userdata/grufor/SOFTWARE/g16/l101.exe) Berny optimization. R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45 R46 R47 R48 R49 R50 1 1 1 3 3 3 3 4 4 5 5 6 7 7 8 8 9 9 10 10 11 15 15 15 16 16 17 22 22 22 23 23 23 24 24 27 29 29 31 31 31 32 32 32 36 36 36 40 40 40 2 4 5 6 7 22 39 7 17 6 8 11 18 39 9 12 10 13 11 14 43 16 18 20 17 21 19 27 29 35 24 25 29 26 27 28 30 35 32 36 40 33 34 35 37 38 39 41 42 43 1.2321 1.4918 1.4918 1.5314 1.5326 1.5349 2.7876 1.4168 1.3996 1.4165 1.3998 1.3661 1.3657 2.7476 1.3859 1.0923 1.4034 1.0911 1.3223 1.0962 2.7096 1.4033 1.3222 1.0962 1.3858 1.0911 1.0923 1.3462 1.3461 2.8052 1.3658 1.0852 1.374 1.0852 1.3742 1.0301 1.0311 2.7495 1.4414 1.4453 1.4439 1.1014 1.1012 1.1144 1.1009 1.1008 1.1119 1.1007 1.1019 1.1118 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 A86 A87 2 2 4 6 6 6 7 22 1 1 7 1 1 6 3 3 5 3 3 4 4 18 5 5 9 8 8 10 9 9 11 6 6 10 16 16 18 15 15 17 4 4 16 7 3 3 3 27 27 24 24 25 23 23 26 22 22 24 22 22 23 23 30 32 32 36 31 31 31 33 33 34 22 31 31 31 37 37 38 3 31 31 31 41 41 42 11 1 1 1 3 3 3 3 3 4 4 4 5 5 5 6 6 6 7 7 7 7 7 8 8 8 9 9 9 10 10 10 11 11 11 15 15 15 16 16 16 17 17 17 18 22 22 22 22 22 23 23 23 24 24 24 27 27 27 29 29 29 29 29 31 31 31 32 32 32 32 32 32 35 36 36 36 36 36 36 39 40 40 40 40 40 40 43 4 5 5 7 22 39 22 39 7 17 17 6 8 8 5 11 11 4 18 18 39 39 9 12 12 10 13 13 11 14 14 10 43 43 18 20 20 17 21 21 16 19 19 15 27 29 35 29 35 25 29 29 26 27 27 24 28 28 23 30 30 35 35 36 40 40 33 34 35 34 35 35 32 37 38 39 38 39 39 36 41 42 43 42 43 43 40 120.6547 120.6525 118.6899 118.924 120.572 90.4159 120.3477 102.942 122.1067 118.8245 119.0633 122.121 118.829 119.0477 119.0851 119.9811 120.9168 119.062 120.0215 120.898 89.5367 103.5045 119.1066 118.64 122.253 118.3051 121.5609 120.1337 123.7875 119.6962 116.5162 118.8353 84.886 111.1902 123.7961 119.6854 116.5184 118.3015 120.1332 121.5646 119.0932 118.6431 122.2632 118.8439 126.9707 126.6674 99.7907 106.3008 91.8745 130.3671 106.6771 122.9557 130.3908 106.6715 122.9373 110.1692 117.3256 132.484 110.1781 117.1073 132.6735 90.8338 96.5581 112.4993 112.2612 112.5883 110.1533 110.2573 113.3439 107.7346 107.6716 107.4765 153.6713 110.0503 110.1272 113.2592 107.7585 107.7574 107.7003 153.8123 110.125 110.085 113.388 107.7169 107.4082 107.9186 153.0165 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 A88 A89 A90 A91 29 7 29 7 35 39 35 39 32 36 32 36 1 13 1 13 -1 -1 -2 -2 180.6401 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 189.7438 178.0764 179.1663 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 D137 D138 D139 D140 D141 D142 D143 2 2 5 5 2 2 4 4 7 7 22 22 39 39 6 6 22 22 6 6 6 7 7 7 39 39 39 6 22 1 1 1 17 17 17 1 1 7 7 1 1 8 8 1 1 6 6 3 3 5 5 3 4 39 4 4 4 18 18 18 5 5 12 12 8 8 13 13 9 9 14 14 6 10 18 18 20 20 16 20 15 15 21 21 3 3 29 29 35 35 3 3 27 27 3 27 25 25 29 29 24 24 24 25 25 25 23 23 26 26 23 23 23 30 30 30 36 36 36 40 40 40 32 32 32 40 40 40 32 32 32 36 36 36 31 33 34 31 37 38 31 41 42 1 1 1 1 1 1 1 1 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 4 4 4 4 4 4 4 4 4 5 5 5 5 5 5 5 5 6 6 6 6 7 7 7 7 7 7 7 7 7 8 8 8 8 9 9 9 9 10 10 10 10 11 11 15 15 15 15 15 15 16 16 16 16 22 22 22 22 22 22 22 22 22 22 22 22 23 23 23 23 23 23 23 23 23 23 24 24 24 24 29 29 29 29 29 29 31 31 31 31 31 31 31 31 31 31 31 31 31 31 31 31 31 31 32 32 32 36 36 36 40 40 40 4 4 4 4 5 5 5 5 6 6 6 6 6 6 7 7 7 7 22 22 22 22 22 22 22 22 22 39 39 7 7 7 7 7 7 17 17 17 17 6 6 6 6 8 8 8 8 11 11 11 11 18 18 18 36 36 36 36 36 36 9 9 9 9 10 10 10 10 11 11 11 11 43 43 16 16 16 16 18 18 17 17 17 17 27 27 27 27 27 27 29 29 29 29 35 35 24 24 24 24 29 29 29 29 29 29 27 27 27 27 32 32 32 32 32 32 32 32 32 32 32 32 36 36 36 36 36 36 40 40 40 40 40 40 35 35 35 39 39 39 43 43 43 7 17 7 17 6 8 6 8 5 11 5 11 5 11 4 18 4 18 27 29 35 27 29 35 27 29 35 36 36 3 18 39 3 18 39 16 19 16 19 3 11 3 11 9 12 9 12 10 43 10 43 15 15 15 31 37 38 31 37 38 10 13 10 13 11 14 11 14 6 43 6 43 40 40 17 21 17 21 7 7 4 19 4 19 24 28 24 28 24 28 23 30 23 30 32 32 26 27 26 27 22 30 35 22 30 35 22 28 22 28 31 33 34 31 33 34 33 34 35 33 34 35 37 38 39 37 38 39 41 42 43 41 42 43 22 22 22 3 3 3 11 11 11 179.7124 -1.1489 -0.89 178.2487 -179.3932 1.16 1.2092 -178.2376 -0.3378 178.1786 -175.81 2.7064 -70.4776 108.0388 0.6384 -177.8148 176.121 -2.3323 -0.6591 176.0998 99.2127 -176.0666 0.6923 -76.1948 -98.9618 77.7971 0.91 -75.714 45.8573 -0.0155 178.4238 72.9193 -179.1522 -0.7129 -106.2174 -178.8669 0.8853 0.2984 -179.9494 -0.59 -179.0921 178.8556 0.3535 179.2554 -0.5286 -0.2086 -179.9926 -178.6979 -67.29 -0.2091 111.1988 178.9967 0.5723 98.275 -152.4277 89.1469 -25.4811 85.9876 -32.4378 -147.0658 -0.0621 -179.8718 179.7138 -0.0959 0.2183 -179.6608 -179.9691 0.1517 -0.0801 -96.0672 179.8026 83.8155 -92.1624 26.8265 -0.3799 179.9297 179.5058 -0.1846 -0.0224 -179.9114 0.2207 -179.5222 179.9064 0.1635 176.7235 -1.8122 -0.5684 -179.104 72.979 -105.5567 -176.7124 1.2543 0.5902 178.5568 -52.4709 75.5733 0.1299 179.9012 -179.7376 0.0337 -0.391 -177.9289 -78.2123 179.7293 2.1914 101.908 0.3343 178.5702 -179.8732 -1.6374 133.7715 10.7866 -104.5538 -93.1139 143.9013 28.5609 -175.8164 -57.045 63.4813 55.9564 174.7278 -64.746 55.8846 174.541 -64.7963 -176.0601 -57.4037 63.2591 -177.9669 -59.3415 61.6595 53.8528 172.4781 -66.5209 21.0586 -101.037 143.1475 -15.0821 -137.0532 106.946 123.6609 1.7591 -114.1257 estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2|estimate D2E/DX2 0.10000e-02 0.10000e-05 F 43 1.00e+00 60 F IExCor= 4639 DFT=T Ex+Corr=wB97XD ExCW=0 ScaHFX= 1.000000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 IRadAn= 5 IRanWt= -1 IRanGd= 0 ICorTp=0 IEmpDi=121 NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. Berny optimization. local minimum Step number 44 out of a maximum of 258 All quantities printed in internal units (Hartrees-Bohrs-Radians) 0.00028 0.00052 0.00097 0.00140 0.00180 0.00298 0.00595 0.00914 0.01041 0.01324 0.01456 0.01586 0.01627 0.01713 0.01778 0.01883 0.01935 0.02059 0.02100 0.02135 0.02137 0.02171 0.02195 0.02199 0.02246 0.02270 0.02302 0.02364 0.02382 0.02498 0.02516 0.02835 0.02942 0.03424 0.03562 0.03686 0.03739 0.04139 0.04512 0.04568 0.05302 0.05498 0.06435 0.06597 0.06987 0.07869 0.08397 0.08617 0.09434 0.10098 0.10813 0.11703 0.11840 0.12818 0.13699 0.14817 0.15782 0.15839 0.15972 0.15993 0.16002 0.16005 0.16011 0.16041 0.16086 0.16194 0.17705 0.18614 0.20775 0.21112 0.21609 0.22132 0.22180 0.23319 0.23932 0.24640 0.25147 0.26110 0.27477 0.27961 0.28621 0.30148 0.30945 0.32234 0.32831 0.33471 0.33552 0.33575 0.33609 0.33619 0.33676 0.34104 0.34113 0.34548 0.34650 0.34684 0.34696 0.35383 0.35387 0.36636 0.37098 0.37241 0.38364 0.39968 0.41075 0.42655 0.42943 0.43320 0.43722 0.43972 0.44450 0.45116 0.46853 0.47024 0.48778 0.49677 0.50845 0.53792 0.58605 0.59956 0.62478 0.62674 0.85031 -2.80636755e-08 R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45 R46 R47 R48 R49 R50 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 A86 A87 A88 A89 A90 A91 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 D137 D138 D139 D140 D141 D142 D143 2.31223 2.81748 2.81749 2.89432 2.89432 2.90260 5.74302 2.67712 2.64499 2.67709 2.64497 2.58122 2.58121 5.70343 2.61892 2.06417 2.65190 2.06192 2.49923 2.07150 5.46831 2.65195 2.49919 2.07151 2.61890 2.06191 2.06420 2.54313 2.54318 5.57261 2.58093 2.05076 2.59704 2.05078 2.59688 1.94767 1.94745 5.56154 2.72755 2.73045 2.72750 2.08190 2.08103 2.10187 2.08040 2.08040 2.10047 2.08104 2.08190 2.10188 2.10544 2.10551 2.07218 2.07528 2.10290 1.29993 2.10314 2.06663 2.13098 2.07403 2.07810 2.13089 2.07412 2.07810 2.07840 2.09424 2.11026 2.07831 2.09430 2.11030 1.29708 2.07678 2.07856 2.07067 2.13395 2.06487 2.12159 2.09671 2.16061 2.08906 2.03351 2.07395 1.38037 2.06217 2.16063 2.08902 2.03354 2.06490 2.09671 2.12157 2.07851 2.07059 2.13408 2.07390 2.21333 2.21379 1.32505 1.85530 2.08461 2.27588 1.86156 2.14574 2.27581 1.86164 2.14574 1.92315 2.04567 2.31396 1.92311 2.04599 2.31369 2.08270 1.25702 1.96301 1.96767 1.96300 1.92080 1.92064 1.98119 1.87952 1.88419 1.87413 2.48931 1.92184 1.92177 1.97715 1.88125 1.87935 1.87936 2.45851 1.92067 1.92080 1.98121 1.87952 1.87406 1.88420 2.69670 3.60687 3.68648 3.53412 3.44781 3.13052 -0.02452 -0.02298 3.10516 -3.13034 0.02488 0.02316 -3.10481 -0.01455 3.10178 -3.09077 0.02556 -1.09808 2.01826 0.01473 -3.10191 3.09093 -0.02571 -0.00937 3.08445 2.02284 -3.08453 0.00928 -1.05233 -1.54560 1.54822 0.48661 -2.03810 -0.00230 0.00414 3.12055 1.11781 -3.12397 -0.00757 -2.01030 -3.12401 0.01324 0.00455 -3.14139 -0.00449 -3.12058 3.12345 0.00736 3.12392 -0.01326 -0.00447 3.14154 -3.11997 -1.09090 -0.00411 2.02496 3.12047 0.00430 1.54666 3.07667 1.13451 -1.04133 0.98996 -0.95219 -3.12804 -0.00126 -3.13892 3.13575 -0.00192 0.00476 -3.13536 -3.14070 0.00236 -0.00202 -1.62234 3.13815 1.51783 -1.76171 0.28012 -0.00487 3.14053 3.13528 -0.00251 0.00199 -3.13820 0.00134 -3.13575 3.13907 0.00198 3.09540 -0.01946 -0.00636 -3.12122 1.45104 -1.66381 -3.09537 0.01951 0.00637 3.12126 -1.92974 0.24492 -0.00027 3.13880 -3.13905 0.00001 -0.00400 -3.11335 -1.50721 3.14014 0.03079 1.63693 0.00398 3.11327 -3.13991 -0.03061 1.61694 -0.29719 -2.17809 -2.37436 1.99470 0.11379 -3.06528 -0.99668 1.10409 0.97599 3.04458 -1.13783 0.98376 3.05581 -1.12183 -3.05507 -0.98302 1.12253 -3.04423 -0.97562 1.13824 0.99703 3.06564 -1.10368 0.96262 -1.17162 3.08949 0.00024 -2.12924 2.12964 1.80856 -0.31832 -2.34036 0.00001 -0.00002 -0.00002 0.00000 -0.00001 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00001 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00001 0.00000 -0.00000 -0.00001 0.00000 0.00001 0.00001 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00001 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00001 -0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00001 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00001 -0.00000 0.00001 -0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00001 -0.00000 -0.00001 0.00000 -0.00000 -0.00000 -0.00046 0.00000 0.00000 -0.00000 0.00001 0.00000 -0.00000 -0.00017 -0.00000 -0.00000 0.00000 -0.00000 -0.00001 0.00000 0.00105 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00048 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00001 -0.00001 0.00031 0.00001 -0.00000 -0.00000 -0.00000 -0.00000 -0.00001 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00001 0.00001 0.00001 0.00003 -0.00001 -0.00005 0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00001 0.00001 0.00000 0.00007 0.00004 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00002 0.00031 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00001 0.00000 -0.00003 -0.00001 0.00010 0.00001 -0.00000 -0.00001 0.00001 -0.00000 -0.00001 0.00001 0.00001 -0.00002 0.00001 0.00003 -0.00004 0.00011 -0.00005 -0.00001 -0.00001 -0.00000 -0.00000 -0.00000 -0.00002 0.00000 0.00001 0.00001 -0.00015 0.00001 0.00000 -0.00001 0.00000 -0.00001 0.00000 0.00015 0.00000 0.00000 0.00001 -0.00000 -0.00000 -0.00001 -0.00027 0.00000 0.00016 0.00022 -0.00025 -0.00004 0.00000 -0.00003 0.00001 -0.00006 -0.00007 -0.00007 -0.00008 0.00000 0.00005 -0.00008 -0.00004 -0.00012 -0.00008 -0.00010 -0.00009 -0.00001 -0.00000 0.00010 0.00009 0.00020 0.00002 0.00001 0.00012 0.00008 0.00008 0.00019 -0.00030 -0.00027 0.00011 0.00010 0.00002 0.00007 0.00006 -0.00002 -0.00006 -0.00005 -0.00002 -0.00001 0.00008 0.00004 0.00009 0.00004 0.00000 -0.00000 -0.00001 -0.00001 -0.00009 0.00025 -0.00005 0.00029 -0.00006 -0.00005 0.00006 -0.00025 -0.00025 -0.00017 -0.00026 -0.00026 -0.00018 -0.00002 -0.00001 -0.00002 -0.00001 0.00002 0.00004 0.00001 0.00003 0.00002 -0.00013 0.00000 -0.00015 0.00037 0.00038 0.00003 0.00003 0.00005 0.00004 0.00000 -0.00001 -0.00002 -0.00003 -0.00001 -0.00003 0.00003 -0.00012 0.00004 -0.00011 -0.00001 -0.00016 -0.00004 0.00008 -0.00004 0.00007 -0.00002 -0.00002 0.00016 0.00016 -0.00001 -0.00001 0.00003 -0.00011 -0.00011 -0.00012 -0.00027 -0.00026 -0.00002 0.00017 -0.00001 0.00017 -0.00018 -0.00014 -0.00015 -0.00021 -0.00018 -0.00019 -0.00012 -0.00012 -0.00011 -0.00010 -0.00010 -0.00009 -0.00006 -0.00005 -0.00005 -0.00008 -0.00007 -0.00007 -0.00004 -0.00004 -0.00004 -0.00001 -0.00001 -0.00002 -0.00016 -0.00015 -0.00016 0.00003 0.00003 0.00003 -0.00052 -0.00052 -0.00052 0.00001 -0.00001 -0.00002 0.00000 -0.00000 -0.00000 -0.00004 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00001 -0.00006 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00002 -0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00001 -0.00014 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00001 -0.00020 0.00001 0.00001 0.00001 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00001 -0.00000 0.00001 -0.00000 -0.00001 0.00002 0.00001 -0.00006 0.00001 -0.00001 0.00000 -0.00001 0.00000 0.00001 0.00001 -0.00000 -0.00000 -0.00001 0.00001 -0.00000 0.00001 -0.00007 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00012 0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00001 0.00008 -0.00001 -0.00001 0.00001 -0.00000 -0.00001 0.00001 -0.00000 -0.00001 0.00000 0.00001 -0.00001 0.00000 0.00001 -0.00001 -0.00000 0.00001 -0.00001 -0.00003 -0.00001 -0.00001 0.00000 -0.00001 0.00000 0.00000 0.00000 0.00013 -0.00000 0.00000 0.00000 -0.00000 0.00001 -0.00001 0.00003 0.00001 -0.00000 -0.00002 0.00000 0.00002 -0.00000 -0.00013 -0.00011 -0.00004 -0.00014 -0.00002 -0.00011 -0.00012 -0.00010 -0.00010 0.00003 0.00005 0.00002 0.00003 -0.00008 -0.00006 -0.00001 0.00000 -0.00008 -0.00006 -0.00000 0.00006 -0.00006 0.00000 -0.00006 0.00000 -0.00002 0.00000 0.00007 0.00004 -0.00004 0.00002 -0.00000 0.00005 0.00005 0.00009 0.00002 0.00011 0.00009 0.00003 0.00011 0.00000 0.00000 -0.00000 -0.00000 0.00007 0.00005 0.00005 0.00003 -0.00003 -0.00003 -0.00001 -0.00002 -0.00004 0.00010 -0.00003 0.00011 -0.00009 -0.00003 -0.00007 -0.00003 -0.00003 -0.00004 -0.00002 -0.00003 -0.00004 -0.00001 -0.00001 -0.00001 -0.00000 0.00002 0.00003 0.00001 0.00002 -0.00000 -0.00007 -0.00001 -0.00008 -0.00019 -0.00018 0.00003 0.00003 0.00001 0.00001 0.00000 0.00002 -0.00003 -0.00002 -0.00002 -0.00002 0.00008 0.00005 0.00002 0.00000 -0.00002 -0.00004 -0.00008 -0.00006 -0.00002 -0.00000 0.00016 0.00020 0.00016 0.00012 0.00004 0.00000 0.00001 -0.00001 -0.00001 -0.00009 -0.00012 -0.00012 -0.00001 0.00001 -0.00005 -0.00002 -0.00005 -0.00011 -0.00019 -0.00007 -0.00013 -0.00021 0.00015 0.00015 0.00016 0.00020 0.00020 0.00021 0.00005 0.00004 0.00003 -0.00002 -0.00002 -0.00003 -0.00003 -0.00003 -0.00005 0.00002 0.00002 0.00000 -0.00028 -0.00027 -0.00028 -0.00010 -0.00010 -0.00010 0.00014 0.00013 0.00012 0.00001 -0.00001 -0.00003 0.00001 -0.00000 -0.00000 -0.00050 0.00000 -0.00000 -0.00001 0.00001 0.00000 -0.00001 -0.00023 -0.00000 -0.00000 0.00001 -0.00000 -0.00001 0.00000 0.00107 -0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00001 0.00001 0.00035 -0.00000 -0.00000 -0.00001 -0.00000 -0.00000 -0.00001 -0.00001 0.00010 0.00003 0.00001 0.00001 -0.00000 -0.00000 -0.00001 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00001 -0.00000 0.00001 0.00000 0.00000 0.00005 -0.00001 -0.00012 0.00001 -0.00001 0.00000 -0.00001 0.00001 0.00001 0.00001 -0.00000 -0.00001 -0.00002 0.00002 0.00000 0.00007 -0.00004 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00003 0.00043 0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00001 0.00001 0.00005 -0.00002 0.00009 0.00001 -0.00000 -0.00001 0.00002 -0.00000 -0.00002 0.00001 0.00002 -0.00003 0.00001 0.00004 -0.00005 0.00011 -0.00004 -0.00002 -0.00004 -0.00001 -0.00001 0.00000 -0.00003 0.00001 0.00001 0.00002 -0.00002 0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00018 0.00001 -0.00000 -0.00001 0.00000 0.00002 -0.00001 -0.00040 -0.00011 0.00012 0.00008 -0.00027 -0.00015 -0.00012 -0.00013 -0.00009 -0.00003 -0.00002 -0.00005 -0.00004 -0.00007 -0.00001 -0.00009 -0.00004 -0.00020 -0.00014 -0.00010 -0.00002 -0.00007 -0.00000 0.00004 0.00010 0.00018 0.00002 0.00008 0.00016 0.00004 0.00010 0.00018 -0.00025 -0.00022 0.00020 0.00012 0.00013 0.00016 0.00009 0.00009 -0.00006 -0.00005 -0.00002 -0.00001 0.00014 0.00009 0.00014 0.00008 -0.00003 -0.00003 -0.00002 -0.00003 -0.00014 0.00034 -0.00008 0.00040 -0.00015 -0.00008 -0.00001 -0.00027 -0.00028 -0.00021 -0.00028 -0.00029 -0.00022 -0.00004 -0.00002 -0.00003 -0.00001 0.00004 0.00007 0.00002 0.00005 0.00002 -0.00020 -0.00001 -0.00023 0.00018 0.00019 0.00006 0.00005 0.00006 0.00005 0.00000 0.00001 -0.00005 -0.00006 -0.00004 -0.00005 0.00011 -0.00007 0.00006 -0.00011 -0.00003 -0.00020 -0.00012 0.00002 -0.00007 0.00007 0.00014 0.00018 0.00032 0.00028 0.00003 -0.00001 0.00005 -0.00012 -0.00012 -0.00022 -0.00039 -0.00038 -0.00003 0.00018 -0.00007 0.00015 -0.00023 -0.00025 -0.00035 -0.00029 -0.00031 -0.00041 0.00004 0.00004 0.00004 0.00011 0.00011 0.00011 -0.00001 -0.00001 -0.00001 -0.00010 -0.00009 -0.00010 -0.00007 -0.00007 -0.00009 0.00000 0.00001 -0.00001 -0.00044 -0.00042 -0.00044 -0.00007 -0.00007 -0.00007 -0.00038 -0.00039 -0.00039 2.31224 2.81747 2.81746 2.89433 2.89431 2.90259 5.74252 2.67712 2.64499 2.67708 2.64497 2.58122 2.58120 5.70320 2.61891 2.06417 2.65191 2.06192 2.49922 2.07150 5.46937 2.65195 2.49920 2.07151 2.61890 2.06191 2.06420 2.54314 2.54319 5.57295 2.58093 2.05076 2.59703 2.05078 2.59688 1.94766 1.94744 5.56164 2.72757 2.73045 2.72750 2.08189 2.08103 2.10186 2.08039 2.08040 2.10047 2.08104 2.08190 2.10188 2.10543 2.10551 2.07219 2.07528 2.10290 1.29998 2.10313 2.06651 2.13099 2.07402 2.07810 2.13088 2.07412 2.07810 2.07841 2.09424 2.11025 2.07829 2.09432 2.11030 1.29715 2.07674 2.07855 2.07067 2.13396 2.06487 2.12159 2.09671 2.16061 2.08906 2.03351 2.07395 1.38035 2.06260 2.16064 2.08901 2.03353 2.06490 2.09671 2.12157 2.07851 2.07059 2.13408 2.07390 2.21334 2.21380 1.32509 1.85529 2.08469 2.27589 1.86156 2.14573 2.27583 1.86163 2.14572 1.92316 2.04569 2.31393 1.92312 2.04603 2.31364 2.08281 1.25698 1.96299 1.96763 1.96299 1.92079 1.92065 1.98116 1.87952 1.88420 1.87415 2.48929 1.92184 1.92178 1.97714 1.88125 1.87935 1.87936 2.45869 1.92068 1.92080 1.98120 1.87952 1.87408 1.88419 2.69630 3.60676 3.68660 3.53420 3.44754 3.13037 -0.02464 -0.02311 3.10507 -3.13037 0.02486 0.02311 -3.10485 -0.01463 3.10176 -3.09086 0.02552 -1.09828 2.01811 0.01463 -3.10194 3.09086 -0.02571 -0.00932 3.08455 2.02303 -3.08451 0.00936 -1.05217 -1.54556 1.54832 0.48679 -2.03835 -0.00251 0.00434 3.12067 1.11793 -3.12381 -0.00748 -2.01021 -3.12407 0.01319 0.00452 -3.14140 -0.00435 -3.12050 3.12358 0.00743 3.12389 -0.01329 -0.00449 3.14151 -3.12011 -1.09056 -0.00419 2.02536 3.12032 0.00422 1.54665 3.07639 1.13423 -1.04155 0.98968 -0.95248 -3.12826 -0.00130 -3.13894 3.13572 -0.00193 0.00480 -3.13530 -3.14068 0.00241 -0.00200 -1.62254 3.13814 1.51760 -1.76153 0.28031 -0.00481 3.14058 3.13534 -0.00246 0.00200 -3.13819 0.00129 -3.13581 3.13903 0.00193 3.09551 -0.01952 -0.00630 -3.12133 1.45102 -1.66401 -3.09549 0.01954 0.00630 3.12133 -1.92960 0.24510 0.00005 3.13908 -3.13903 0.00000 -0.00395 -3.11347 -1.50732 3.13993 0.03040 1.63655 0.00394 3.11345 -3.13998 -0.03047 1.61671 -0.29744 -2.17844 -2.37465 1.99439 0.11339 -3.06524 -0.99665 1.10413 0.97610 3.04469 -1.13772 0.98374 3.05580 -1.12184 -3.05517 -0.98311 1.12243 -3.04430 -0.97569 1.13815 0.99704 3.06565 -1.10369 0.96217 -1.17204 3.08905 0.00017 -2.12931 2.12957 1.80818 -0.31871 -2.34075 |Maximum Force|RMS Force|Maximum Displacement|RMS Displacement| 0.000017 0.000003 0.001421 0.000295 0.000450 0.000300 0.001800 0.001200 YES YES YES YES -1.403273e-08 Optimization completed. -- Stationary point found. R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45 R46 R47 R48 R49 R50 1 1 1 3 3 3 3 4 4 5 5 6 7 7 8 8 9 9 10 10 11 15 15 15 16 16 17 22 22 22 23 23 23 24 24 27 29 29 31 31 31 32 32 32 36 36 36 40 40 40 2 4 5 6 7 22 39 7 17 6 8 11 18 39 9 12 10 13 11 14 43 16 18 20 17 21 19 27 29 35 24 25 29 26 27 28 30 35 32 36 40 33 34 35 37 38 39 41 42 43 1.2236 1.4909 1.491 1.5316 1.5316 1.536 3.0391 1.4167 1.3997 1.4167 1.3997 1.3659 1.3659 3.0181 1.3859 1.0923 1.4033 1.0911 1.3225 1.0962 2.8937 1.4034 1.3225 1.0962 1.3859 1.0911 1.0923 1.3458 1.3458 2.9489 1.3658 1.0852 1.3743 1.0852 1.3742 1.0307 1.0305 2.943 1.4434 1.4449 1.4433 1.1017 1.1012 1.1123 1.1009 1.1009 1.1115 1.1012 1.1017 1.1123 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 A86 A87 2 2 4 6 6 6 7 22 1 1 7 1 1 6 3 3 5 3 3 4 4 18 5 5 9 8 8 10 9 9 11 6 6 10 16 16 18 15 15 17 4 4 16 7 3 3 3 27 27 24 24 25 23 23 26 22 22 24 22 22 23 23 30 32 32 36 31 31 31 33 33 34 22 31 31 31 37 37 38 3 31 31 31 41 41 42 11 1 1 1 3 3 3 3 3 4 4 4 5 5 5 6 6 6 7 7 7 7 7 8 8 8 9 9 9 10 10 10 11 11 11 15 15 15 16 16 16 17 17 17 18 22 22 22 22 22 23 23 23 24 24 24 27 27 27 29 29 29 29 29 31 31 31 32 32 32 32 32 32 35 36 36 36 36 36 36 39 40 40 40 40 40 40 43 4 5 5 7 22 39 22 39 7 17 17 6 8 8 5 11 11 4 18 18 39 39 9 12 12 10 13 13 11 14 14 10 43 43 18 20 20 17 21 21 16 19 19 15 27 29 35 29 35 25 29 29 26 27 27 24 28 28 23 30 30 35 35 36 40 40 33 34 35 34 35 35 32 37 38 39 38 39 39 36 41 42 43 42 43 43 40 120.6327 120.6366 118.7271 118.9045 120.4872 74.4802 120.5011 118.409 122.0963 118.8331 119.0662 122.0913 118.8381 119.0661 119.0837 119.9912 120.9089 119.0784 119.9947 120.9111 74.3172 118.9905 119.0926 118.6404 122.2665 118.3085 121.5582 120.1329 123.794 119.6945 116.5115 118.8284 79.0895 118.1535 123.7951 119.6918 116.513 118.3101 120.1324 121.5571 119.0901 118.6359 122.2735 118.8259 126.8145 126.8408 75.9196 106.301 119.4392 130.3982 106.6597 122.9419 130.3942 106.6639 122.9418 110.1882 117.2083 132.5803 110.1858 117.2264 132.5646 119.3299 72.0222 112.4724 112.7391 112.4719 110.0536 110.0447 113.5138 107.6886 107.9562 107.38 142.6268 110.1131 110.1095 113.2823 107.7875 107.679 107.6795 140.8623 110.0463 110.054 113.5152 107.6884 107.3758 107.9569 154.5094 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0 A88 A89 A90 29 7 29 35 39 35 32 36 32 1 13 1 -1 -1 -2 206.6583 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0 211.2198 202.4901 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 D137 D138 D139 D140 D141 D142 2 2 5 5 2 2 4 4 7 7 22 22 39 39 6 6 22 22 6 6 6 7 7 7 39 39 39 6 22 1 1 1 17 17 17 1 1 7 7 1 1 8 8 1 1 6 6 3 3 5 5 3 4 39 4 4 4 18 18 18 5 5 12 12 8 8 13 13 9 9 14 14 6 10 18 18 20 20 16 20 15 15 21 21 3 3 29 29 35 35 3 3 27 27 3 27 25 25 29 29 24 24 24 25 25 25 23 23 26 26 23 23 23 30 30 30 36 36 36 40 40 40 32 32 32 40 40 40 32 32 32 36 36 36 31 33 34 31 37 38 31 41 1 1 1 1 1 1 1 1 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 4 4 4 4 4 4 4 4 4 5 5 5 5 5 5 5 5 6 6 6 6 7 7 7 7 7 7 7 7 7 8 8 8 8 9 9 9 9 10 10 10 10 11 11 15 15 15 15 15 15 16 16 16 16 22 22 22 22 22 22 22 22 22 22 22 22 23 23 23 23 23 23 23 23 23 23 24 24 24 24 29 29 29 29 29 29 31 31 31 31 31 31 31 31 31 31 31 31 31 31 31 31 31 31 32 32 32 36 36 36 40 40 4 4 4 4 5 5 5 5 6 6 6 6 6 6 7 7 7 7 22 22 22 22 22 22 22 22 22 39 39 7 7 7 7 7 7 17 17 17 17 6 6 6 6 8 8 8 8 11 11 11 11 18 18 18 36 36 36 36 36 36 9 9 9 9 10 10 10 10 11 11 11 11 43 43 16 16 16 16 18 18 17 17 17 17 27 27 27 27 27 27 29 29 29 29 35 35 24 24 24 24 29 29 29 29 29 29 27 27 27 27 32 32 32 32 32 32 32 32 32 32 32 32 36 36 36 36 36 36 40 40 40 40 40 40 35 35 35 39 39 39 43 43 7 17 7 17 6 8 6 8 5 11 5 11 5 11 4 18 4 18 27 29 35 27 29 35 27 29 35 36 36 3 18 39 3 18 39 16 19 16 19 3 11 3 11 9 12 9 12 10 43 10 43 15 15 15 31 37 38 31 37 38 10 13 10 13 11 14 11 14 6 43 6 43 40 40 17 21 17 21 7 7 4 19 4 19 24 28 24 28 24 28 23 30 23 30 32 32 26 27 26 27 22 30 35 22 30 35 22 28 22 28 31 33 34 31 33 34 33 34 35 33 34 35 37 38 39 37 38 39 41 42 43 41 42 43 22 22 22 3 3 3 11 11 179.3658 -1.4049 -1.3166 177.9127 -179.3553 1.4253 1.3271 -177.8923 -0.8339 177.7187 -177.0881 1.4645 -62.9151 115.6376 0.8438 -177.7265 177.0975 -1.4728 -0.5366 176.7259 115.9003 -176.7307 0.5318 -60.2938 -88.5561 88.7064 27.8808 -116.7746 -0.1316 0.2373 178.7941 64.0456 -178.9903 -0.4335 -115.182 -178.9926 0.7587 0.2605 -179.9883 -0.2573 -178.7962 178.9604 0.4214 178.9872 -0.7597 -0.2562 179.997 -178.7614 -62.5041 -0.2356 116.0217 178.7899 0.2462 88.6171 176.2801 65.0027 -59.6641 56.7207 -54.5567 -179.2235 -0.0722 -179.8471 179.6651 -0.1098 0.2728 -179.643 -179.949 0.1352 -0.1156 -92.9532 179.8026 86.965 -100.9383 16.0498 -0.2788 179.9389 179.6383 -0.1439 0.1141 -179.8055 0.0765 -179.6653 179.8554 0.1136 177.3531 -1.1149 -0.3645 -178.8325 83.1387 -95.3293 -177.3519 1.1181 0.365 178.835 -110.5662 14.0328 -0.0154 179.8399 -179.8546 0.0007 -0.2289 -178.3816 -86.3566 179.917 1.7643 93.7893 0.2278 178.3773 -179.9036 -1.7541 92.6437 -17.0276 -124.7955 -136.041 114.2877 6.5198 -175.6274 -57.1057 63.2595 55.9201 174.4418 -65.193 56.365 175.0851 -64.2759 -175.0428 -56.3227 64.3163 -174.4216 -55.8988 65.2165 57.1256 175.6484 -63.2363 55.1538 -67.1291 177.0147 0.0136 -121.9965 122.0194 103.6226 -18.2382 -DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0|-DE/DX = 0.0 1 Grimme-D2 -0.0362505490 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 301.02579999999995 AuxInfo=1/0/N:9,16,8,17,10,15,23,24,5,4,1,6,7,22,3,11,18,29,27,2;32,36,40,31/E:(1,2)(3,4)(5,6)(7,8)(9,10)(12,13)(16,17)(18,19);(1,2,3)/CRV:1.3,2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,16.2,17.2,20.1;/rA:43nC3O1BC3C3C3C3C3C3C3N2HHHC3C3C3N2HHHC3C3C3HHNHNHNCHHHCHHHCHHH/rB:s1;;s1;s1;s3s5;s3s4;s5;s8;s9;s6s10;s8;s9;s10;;s15;s4s16;s7s15;s17;s15;s16;s3;;s23;s23;s24;s22s24;s27;s22s23;s29;;s31;s32;s32;s32;s31;s36;s36;s36;s31;s40;s40;s40;/rC:-2.723,.277,-.0604;-3.8939,.4547,.2794;.0817,-.1485,-.8881;-2.1616,-1.1013,-.1633;-1.8348,1.4366,-.3639;-.4881,1.268,-.7692;-.8219,-1.3413,-.5567;-2.3478,2.7324,-.2322;-1.5231,3.8141,-.4976;-.1992,3.5614,-.8885;.3089,2.348,-1.0233;-3.3871,2.8547,.0809;-1.8806,4.8409,-.4057;.4745,4.4002,-1.0987;-1.1185,-3.6222,-.3019;-2.4587,-3.471,.0859;-2.9816,-2.1895,.1566;-.324,-2.6118,-.6118;-4.0136,-1.9967,.4583;-.6794,-4.6251,-.3576;-3.0613,-4.3479,.3278;1.5616,-.3684,-1.2311;3.5385,-1.3482,-1.5584;3.7172,.0013,-1.6699;4.2514,-2.1615,-1.6488;4.6134,.5772,-1.8768;2.487,.5797,-1.4691;2.175,1.5612,-1.4467;2.2053,-1.5489,-1.294;1.6489,-2.3978,-1.1118;1.7536,.3171,2.9352;2.735,-.6008,2.4136;3.7455,-.1749,2.5169;2.7102,-1.5464,2.9775;2.5805,-.8483,1.3381;.4166,-.2315,2.9134;.3911,-1.1854,3.4623;-.2842,.4589,3.4072;.0366,-.4213,1.8858;1.8307,1.6152,2.3076;1.0923,2.2972,2.7561;2.8298,2.0525,2.4644;1.637,1.5884,1.2131; 0.000000 1.232105 0.000000 2.955121 4.187218 0.000000 1.491831 2.370231 2.542768 0.000000 1.491845 2.370218 2.541783 2.566715 0.000000 2.545419 3.655227 1.531438 2.963302 1.416470 0.000000 2.545475 3.655393 1.532636 1.416752 2.963075 2.639063 0.000000 2.489783 2.800038 3.825228 3.838812 1.399812 2.427201 4.362132 0.000000 3.760533 4.184507 4.293052 4.967937 2.401541 2.761835 5.203152 1.385860 0.000000 4.224030 4.966575 3.720515 5.110537 2.732253 2.314609 4.953149 2.394694 1.403398 0.000000 3.795886 4.790175 2.510488 4.329068 2.420982 1.366128 3.886790 2.798527 2.404613 1.322344 0.000000 2.665603 2.460986 4.689483 4.148678 2.149052 3.412430 4.959143 1.092330 2.174745 3.406187 3.890596 0.000000 4.653755 4.874570 5.383084 5.953742 3.404818 3.851866 6.273950 2.166582 1.091121 2.167379 3.374904 2.539897 0.000000 5.320027 6.045630 4.570491 6.171749 3.828292 3.293327 5.910893 3.390853 2.166894 1.096199 2.060232 4.323446 2.494236 0.000000 4.223409 4.966110 3.721694 2.731754 5.109709 4.952786 2.314268 6.472815 7.449909 7.265935 6.180775 6.873442 8.498003 8.217798 0.000000 3.760176 4.184278 4.294322 2.401206 4.967504 5.203091 2.761848 6.212505 7.368042 7.450440 6.538405 6.393472 8.346424 8.483068 1.403343 0.000000 2.489573 2.799882 3.826378 1.399648 3.838625 4.362231 2.427497 4.977771 6.212786 6.473582 5.727924 5.061099 7.138280 7.546201 2.394574 1.385828 0.000000 3.795351 4.789779 2.511716 2.420658 4.328255 3.886436 1.365729 5.727141 6.537815 6.180641 5.016938 6.304391 7.616296 7.074091 1.322229 2.404560 2.798498 0.000000 2.665422 2.460814 4.690413 2.148925 4.148564 4.959207 3.412710 5.061209 6.393853 6.874283 6.305203 4.906239 7.214455 7.967900 3.406114 2.174805 1.092312 3.890541 0.000000 5.319397 6.045135 4.571713 3.827814 6.170884 5.910541 3.292974 7.545341 8.482434 8.217731 7.074198 7.966942 9.542029 9.128897 1.096222 2.166748 3.390692 2.060174 4.323333 0.000000 4.653510 4.874473 5.384380 3.404555 5.953421 6.273959 3.851881 7.138138 8.346568 8.498684 7.617007 7.214212 9.293302 9.542836 2.167335 1.091134 2.166601 3.374824 2.540086 2.494013 0.000000 4.488287 5.720275 1.534899 3.941984 3.942813 2.663146 2.661206 5.088806 5.248509 4.319841 2.998561 6.049749 6.298168 4.892752 4.316648 5.246210 5.087478 2.995253 6.048742 4.889163 6.295765 0.000000 6.640228 7.865736 3.719972 5.873587 6.168913 4.866349 4.474018 7.284178 7.307216 6.206741 4.937509 8.265405 8.306704 6.530237 5.332737 6.570899 6.794213 4.172761 7.843591 5.474527 7.490867 2.230602 0.000000 6.644023 7.869875 3.721611 6.168146 5.881420 4.483362 4.862617 6.805164 6.585817 5.350049 4.188278 7.853593 7.507052 5.494706 6.195608 7.299403 7.280788 4.927390 8.263537 6.515774 8.297815 2.230710 1.365845 0.000000 7.557222 8.769751 4.692193 6.667627 7.186049 5.915876 5.253914 8.337007 8.389127 7.289475 6.022421 9.300574 9.390404 7.590954 5.725726 7.053325 7.454963 4.713009 8.530916 5.661185 7.884309 3.259535 1.085196 2.227821 0.000000 7.563856 8.777155 4.694678 7.187063 6.678827 5.265829 5.913149 7.470415 7.073605 5.748247 4.732047 8.545596 7.906626 5.687741 7.278084 8.381795 8.335070 6.012313 9.300638 7.575311 9.381747 3.259567 2.228029 1.085194 2.771911 0.000000 5.405600 6.617364 2.579407 5.112798 4.542486 3.132881 3.933390 5.435005 5.242725 4.054993 2.840713 6.487184 6.193915 4.333968 5.658519 6.579243 6.341735 4.338514 7.253308 6.192875 7.635034 1.346161 2.197891 1.374154 3.264871 2.165079 0.000000 5.249949 6.405971 2.759926 5.248110 4.155381 2.763588 4.265918 4.827300 4.433147 3.154238 2.068997 5.911385 5.318694 3.327573 6.247108 7.010240 6.574937 4.935215 7.388284 6.899587 8.092301 2.036270 3.215037 2.204877 4.267349 2.664312 1.030110 0.000000 5.398531 6.609891 2.575935 4.533064 5.108942 3.932535 3.122589 6.339380 6.580079 5.662266 4.342315 7.249661 7.636335 6.198862 4.041104 5.229834 5.423879 2.827082 6.476510 4.319816 6.180688 1.346076 1.373959 2.197814 2.165089 3.264841 2.154362 3.114042 0.000000 5.232019 6.387128 2.750513 4.135311 5.234368 4.257000 2.743970 6.562473 7.001888 6.243143 4.932128 7.373808 8.084209 6.898674 3.132745 4.411235 4.805637 2.046540 5.889824 3.309202 5.297303 2.034708 2.207162 3.216306 2.667765 4.268930 3.113765 4.007798 1.031128 0.000000 5.386568 6.242328 4.198689 5.190475 5.001395 4.433058 4.645008 5.717246 5.894867 5.381403 4.677707 6.404142 6.695774 5.880452 5.852011 6.341254 6.035336 5.047399 6.689458 6.417705 7.193295 4.226621 5.113885 5.016195 5.778850 5.603675 4.472615 4.574560 4.644617 4.874381 0.000000 6.056522 7.043571 4.259760 5.555883 5.722683 4.900141 4.692805 6.629103 6.789535 6.069385 5.137464 7.406910 7.672303 6.515822 5.599372 6.374259 6.348034 4.749247 7.163472 5.960936 7.210299 3.835978 4.120875 4.242924 4.608530 4.829481 4.065773 4.459848 3.863490 4.103355 1.441418 0.000000 6.977730 7.985244 5.001772 6.552531 6.483546 5.550157 5.627456 7.289590 7.263452 6.412305 5.541491 8.123242 8.084133 6.686071 6.594577 7.434131 7.408331 5.682300 8.231664 6.902633 8.278782 4.342151 4.245913 4.190593 4.642770 4.541319 4.247500 4.603365 4.334007 4.743868 2.093996 1.101433 0.000000 6.486458 7.409412 4.879095 5.813574 6.381297 5.673449 5.000832 7.361619 7.663683 7.035636 6.077718 8.058388 8.562651 7.548201 5.451891 6.227663 6.384974 4.819260 7.194385 5.664879 6.941181 4.518723 4.615166 5.000726 4.914870 5.629893 4.933761 5.432979 4.301281 4.309718 2.095122 1.101217 1.778979 0.000000 5.599058 6.688569 3.418945 4.980524 5.254790 4.282035 3.925454 6.290874 6.476676 5.668326 4.577391 7.134795 7.437023 6.157909 4.905795 5.817210 5.842209 3.917681 6.750895 5.269345 6.715443 2.805161 3.091509 3.325924 3.665734 4.062047 3.150891 3.704779 2.749493 3.044754 2.143067 1.114447 1.788961 1.786558 0.000000 4.354251 5.098022 3.817074 4.107289 4.311879 4.077824 3.847956 5.130408 5.635955 5.405534 4.707733 5.658271 6.482479 6.128019 4.918535 5.172693 4.793898 4.317607 5.363797 5.586092 5.977122 4.301869 5.566913 5.652828 6.264482 6.419703 4.914323 5.031549 4.757885 4.734302 1.445290 2.400201 3.352888 2.644569 2.746711 0.000000 4.924052 5.584143 4.482954 4.434921 5.144902 4.969751 4.200948 6.041537 6.658857 6.466136 5.710758 6.483185 7.512574 7.211743 4.731428 4.974493 4.828119 4.375484 5.392926 5.250626 5.634303 4.905658 5.927982 6.229860 6.479065 7.031438 5.641593 5.901321 5.103589 4.896408 2.095689 2.633538 3.628658 2.396643 3.069147 1.100917 0.000000 4.243295 4.776376 4.353434 4.325228 4.193069 4.258989 4.386593 4.761547 5.295245 5.299641 4.852817 5.141243 6.023994 6.034286 5.577603 5.586064 4.985637 5.058051 5.351152 6.338567 6.348284 5.060142 6.522017 6.480568 7.280195 7.205623 5.610036 5.551923 5.686030 5.685014 2.096530 3.350471 4.175270 3.629399 3.767849 1.100764 1.778466 0.000000 3.448308 4.335537 2.787624 3.081123 3.466288 3.190317 2.747559 4.485148 5.104059 4.859437 4.025654 5.070639 6.051178 5.687312 4.045574 4.332099 3.902072 3.341682 4.574239 4.818489 5.238571 3.470349 4.998582 5.135046 5.769444 6.008440 4.273404 4.428223 4.010797 3.936002 2.143460 2.755413 3.770298 3.099382 2.637031 1.111912 1.787471 1.786697 0.000000 5.304199 6.183209 4.047417 5.424304 4.539263 3.868361 4.897003 5.015807 4.894099 4.257147 3.734614 5.806910 5.616131 4.604138 6.552708 7.014575 6.500824 5.570751 7.114878 7.234973 7.963008 4.065589 5.161811 4.688670 5.981254 5.131206 3.970619 3.770439 4.808697 5.275317 1.443912 2.395718 2.629583 3.349300 2.751533 2.403520 3.354039 2.649355 2.746625 0.000000 5.154704 5.864485 4.503662 5.537238 4.363888 3.998161 5.279892 4.577527 4.441629 4.068141 3.860071 5.247195 5.030488 4.434388 7.019929 7.280956 6.594325 6.119454 7.056081 7.794403 8.204076 4.819073 6.155360 5.634789 7.018735 6.067938 4.769395 4.402042 5.695210 6.108485 2.095268 3.348728 3.634277 4.176096 3.757640 2.622148 3.622068 2.387070 3.043381 1.100718 0.000000 6.353075 7.248237 4.861670 6.462677 5.489808 4.699029 5.829231 5.877215 5.551998 4.763812 4.313493 6.706352 6.180681 4.873871 7.446165 8.008481 7.556053 6.416105 8.200829 8.054152 8.957469 4.596318 5.315136 4.699731 6.057805 4.919701 4.214130 3.995897 5.242784 5.830028 2.095661 2.655511 2.408902 3.637279 3.121837 3.352924 4.174694 3.622962 3.775833 1.101885 1.778740 0.000000 4.727717 5.722628 3.138578 4.853708 3.816220 2.923761 4.214408 4.390426 4.226837 3.417730 2.709612 5.303480 5.056916 3.821200 6.085995 6.606302 6.059747 4.981770 6.734388 6.814748 7.622179 3.131920 4.463320 3.893324 5.393257 4.407803 2.988983 2.713835 4.056091 4.614674 2.143713 2.727572 3.042244 3.753941 2.616039 2.773533 3.782309 3.127464 2.655717 1.111808 1.783243 1.790000 0.000000 0.2692060 0.2347757 0.1809216 -14.41924 -10.37088 -10.36885 -10.36515 -10.36454 -10.33853 -10.33830 -10.31320 -10.31297 -10.31082 -10.31055 -10.30798 -10.30498 -10.30484 -10.30295 -10.29978 -10.29967 -10.29960 -6.80750 -1.16028 -1.10787 -1.03354 -1.03348 -1.01861 -1.00428 -0.90117 -0.89294 -0.88852 -0.86685 -0.84116 -0.78561 -0.78235 -0.75821 -0.75553 -0.74344 -0.72936 -0.71868 -0.69500 -0.68665 -0.66509 -0.63808 -0.61407 -0.60944 -0.59502 -0.57827 -0.57600 -0.56299 -0.56006 -0.55544 -0.54785 -0.54424 -0.54390 -0.54365 -0.54077 -0.51310 -0.50009 -0.49478 -0.48912 -0.48663 -0.47736 -0.47349 -0.46672 -0.46153 -0.46037 -0.43971 -0.43839 -0.43422 -0.43332 -0.42923 -0.41297 -0.38477 -0.36937 -0.36179 -0.34765 -0.34588 -0.34215 -0.32826 -0.32223 -0.27685 -0.21332 -0.00133 0.04451 0.04975 0.05250 0.07939 0.12687 0.13368 0.14275 0.15429 0.15859 0.17046 0.17264 0.18278 0.18780 0.18886 0.19775 0.20007 0.20511 0.20929 0.21707 0.22219 0.22667 0.23036 0.23811 0.24196 0.24428 0.25725 0.26152 0.26702 0.27986 0.28036 0.28858 0.29333 0.31426 0.32094 0.32497 0.33226 0.33745 0.34564 0.34958 0.36008 0.36666 0.37253 0.37753 0.38845 0.39834 0.40274 0.41132 0.41970 0.42493 0.44197 0.46396 0.47595 0.48205 0.48611 0.49229 0.49439 0.50904 0.51674 0.52110 0.52908 0.53196 0.53342 0.54444 0.54477 0.54830 0.55312 0.55892 0.56561 0.57780 0.58511 0.59125 0.59739 0.61011 0.62285 0.63369 0.64072 0.64382 0.64817 0.65860 0.66741 0.66982 0.67778 0.68640 0.69830 0.70249 0.70517 0.70940 0.71170 0.72383 0.72799 0.72932 0.73610 0.73809 0.74223 0.74504 0.74682 0.74984 0.75803 0.75817 0.76294 0.76710 0.77494 0.77954 0.78449 0.78772 0.79543 0.80838 0.81223 0.81374 0.81590 0.82098 0.82638 0.82887 0.83338 0.83577 0.84968 0.85124 0.85690 0.86204 0.87303 0.88276 0.89944 0.90370 0.92749 0.93259 0.94027 0.95879 0.96642 0.97825 0.99498 1.00407 1.01208 1.01470 1.02576 1.03295 1.05068 1.05825 1.08179 1.09219 1.10393 1.11233 1.11724 1.13843 1.14458 1.15223 1.16253 1.17948 1.18752 1.19846 1.20879 1.22346 1.23457 1.23881 1.24631 1.25726 1.27069 1.28024 1.28584 1.29116 1.30587 1.31456 1.32104 1.33083 1.33890 1.34209 1.34480 1.36215 1.36858 1.37142 1.37469 1.38477 1.39591 1.40096 1.41190 1.41857 1.43600 1.44461 1.45425 1.46040 1.49003 1.51385 1.52959 1.56656 1.57413 1.58260 1.58642 1.59279 1.59823 1.60314 1.63298 1.64662 1.65174 1.66412 1.67693 1.70246 1.72838 1.74438 1.75142 1.76020 1.77828 1.78270 1.78495 1.79613 1.79952 1.80658 1.82071 1.82549 1.83143 1.84767 1.85019 1.85428 1.85806 1.85938 1.85948 1.87467 1.88624 1.88997 1.89247 1.89971 1.91188 1.91505 1.92033 1.92771 1.93949 1.94688 1.94776 1.95232 1.95945 1.97577 1.97816 2.00255 2.01086 2.01638 2.01939 2.02222 2.03047 2.03709 2.04303 2.04727 2.06479 2.07181 2.08376 2.09479 2.10750 2.10841 2.11505 2.12153 2.12925 2.13954 2.14279 2.15312 2.18705 2.20472 2.21136 2.22391 2.22892 2.23921 2.27000 2.28713 2.28952 2.29593 2.32425 2.32650 2.33125 2.34934 2.35650 2.36582 2.36635 2.38641 2.39646 2.40183 2.41645 2.44975 2.45271 2.46610 2.47558 2.48013 2.48626 2.50687 2.51319 2.51764 2.51921 2.53074 2.53536 2.54735 2.55125 2.57160 2.58319 2.61892 2.66076 2.67555 2.68002 2.68646 2.69152 2.73573 2.73987 2.74754 2.75345 2.76248 2.78345 2.80335 2.80524 2.80901 2.81044 2.81839 2.82711 2.82945 2.83643 2.86413 2.86674 2.89763 2.90551 2.91480 2.93092 2.94502 2.97636 2.97934 2.99183 2.99823 3.00510 3.01751 3.03450 3.05257 3.06934 3.11800 3.12383 3.14874 3.18914 3.19797 3.21339 3.23354 3.24180 3.24666 3.26377 3.27089 3.27713 3.38754 3.48346 3.49023 3.49048 3.61350 3.67181 3.72476 3.75466 3.76377 -19.22033 -14.51956 -14.51875 -14.44356 -14.44348 -14.41922 -10.37153 -10.36923 -10.36498 -10.36437 -10.33934 -10.33910 -10.31400 -10.31376 -10.31161 -10.31133 -10.30797 -10.30366 -10.30353 -10.30294 -10.29968 -10.29830 -10.29824 -6.80425 -1.15821 -1.10128 -1.03158 -1.03150 -1.01533 -1.00423 -0.89826 -0.89126 -0.88651 -0.86481 -0.84006 -0.78557 -0.78218 -0.75538 -0.75425 -0.74245 -0.72497 -0.71694 -0.69489 -0.68438 -0.66492 -0.63629 -0.61318 -0.60542 -0.59379 -0.57715 -0.57067 -0.56252 -0.55907 -0.55219 -0.54557 -0.54400 -0.54360 -0.54293 -0.53980 -0.50613 -0.49796 -0.49214 -0.48599 -0.48579 -0.47625 -0.47183 -0.46435 -0.46059 -0.45102 -0.43832 -0.43727 -0.43370 -0.43310 -0.41901 -0.41092 -0.37015 -0.36344 -0.35012 -0.34272 -0.33941 -0.33478 -0.32370 -0.31819 -0.27624 -0.02856 0.00914 0.05341 0.05904 0.06544 0.08375 0.12735 0.14151 0.14280 0.15446 0.15877 0.17078 0.18252 0.18601 0.18836 0.19083 0.19827 0.20048 0.20515 0.20918 0.21718 0.22375 0.23099 0.23263 0.23824 0.24220 0.24463 0.25799 0.26253 0.26733 0.27990 0.28082 0.28806 0.29420 0.31723 0.32030 0.32680 0.33546 0.34376 0.34771 0.35141 0.36375 0.36812 0.37290 0.37824 0.38909 0.40092 0.40344 0.41175 0.41986 0.42503 0.44319 0.46479 0.47715 0.48298 0.49058 0.49521 0.49962 0.51028 0.51985 0.52160 0.53060 0.53263 0.53567 0.54478 0.54634 0.54860 0.55456 0.55920 0.56649 0.57814 0.58763 0.59151 0.59838 0.60914 0.62294 0.63316 0.64206 0.64480 0.64963 0.66011 0.66900 0.67035 0.68030 0.68739 0.69978 0.70299 0.70533 0.71018 0.71222 0.72387 0.72824 0.73012 0.73634 0.73825 0.74286 0.74568 0.74793 0.75006 0.75810 0.75919 0.76371 0.76790 0.77638 0.78042 0.78554 0.78885 0.79612 0.80917 0.81253 0.81438 0.81665 0.82205 0.82717 0.82997 0.83457 0.83631 0.85092 0.85248 0.85848 0.86307 0.87413 0.88340 0.90069 0.90553 0.92836 0.93301 0.94128 0.96046 0.96873 0.98020 0.99588 1.00628 1.01331 1.01813 1.02738 1.03448 1.05139 1.05915 1.08495 1.09396 1.10643 1.11625 1.12362 1.14577 1.14944 1.16165 1.16486 1.18830 1.18988 1.19942 1.20931 1.22510 1.23603 1.23992 1.24722 1.25962 1.27189 1.28166 1.28801 1.29229 1.30705 1.31535 1.32226 1.33197 1.34018 1.34277 1.34617 1.36485 1.37014 1.37299 1.37636 1.38612 1.39731 1.40137 1.41385 1.42029 1.44131 1.44851 1.45538 1.46209 1.49210 1.51598 1.53153 1.56803 1.57545 1.58313 1.58740 1.59901 1.60216 1.60693 1.63342 1.64838 1.65369 1.66477 1.67943 1.70615 1.73105 1.74529 1.75296 1.76102 1.77922 1.78319 1.78547 1.79687 1.80057 1.80775 1.82309 1.82573 1.83295 1.84925 1.85230 1.85707 1.85895 1.86022 1.86100 1.87510 1.88740 1.89115 1.89336 1.90019 1.91261 1.91591 1.92086 1.92823 1.94060 1.94695 1.94807 1.95260 1.96018 1.97588 1.97835 2.00347 2.01185 2.01754 2.02103 2.02486 2.03104 2.03862 2.04665 2.04892 2.06607 2.07262 2.08439 2.09539 2.10780 2.10919 2.11566 2.12244 2.13123 2.14130 2.14324 2.15357 2.18843 2.20633 2.21191 2.22479 2.22968 2.24128 2.27035 2.28689 2.28954 2.29581 2.32672 2.32738 2.33378 2.34997 2.35694 2.36693 2.36742 2.38812 2.39665 2.40200 2.41811 2.45241 2.45427 2.46647 2.47634 2.48078 2.48830 2.50892 2.51466 2.51906 2.51998 2.53131 2.53557 2.55012 2.55295 2.57412 2.58495 2.62057 2.66240 2.67857 2.68271 2.68786 2.69426 2.73718 2.74038 2.74897 2.75467 2.76293 2.78419 2.80464 2.80781 2.80987 2.81107 2.82672 2.82888 2.83391 2.83764 2.86517 2.87442 2.90066 2.90869 2.91554 2.93269 2.94711 2.97667 2.97968 2.99375 2.99880 3.00563 3.01893 3.03505 3.05328 3.06969 3.11861 3.12445 3.15105 3.19084 3.19913 3.21436 3.24152 3.24262 3.24752 3.26458 3.27101 3.27760 3.38831 3.48479 3.49153 3.49161 3.61489 3.67282 3.72575 3.75822 3.76458 5.8810 -1.0202 -2.0926 6.3250 -133.3197 -118.9456 -147.4421 0.2487 -10.2590 -1.6095 -0.0839 14.2902 -14.2063 0.2487 -10.2590 -1.6095 138.5832 0.2234 -12.1719 -7.2864 -23.3718 -36.2584 1.1125 -4.0035 -2.7075 3.6024 -4014.1332 -3072.6612 -1963.6036 33.3461 -143.4218 -24.9095 -16.9443 -81.5464 -15.8288 -1102.4608 -983.4920 -900.5365 -6.0613 -48.8779 -14.0430 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 301.02579999999995 AuxInfo=1/0/N:9,16,8,17,10,15,23,24,5,4,1,6,7,22,3,11,18,29,27,2;32,36,40,31/E:(1,2)(3,4)(5,6)(7,8)(9,10)(12,13)(16,17)(18,19);(1,2,3)/CRV:1.3,2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,16.2,17.2,20.1;/rA:43nC3O1BC3C3C3C3C3C3C3N2HHHC3C3C3N2HHHC3C3C3HHNHNHNCHHHCHHHCHHH/rB:s1;;s1;s1;s3s5;s3s4;s5;s8;s9;s6s10;s8;s9;s10;;s15;s4s16;s7s15;s17;s15;s16;s3;;s23;s23;s24;s22s24;s27;s22s23;s29;;s31;s32;s32;s32;s31;s36;s36;s36;s31;s40;s40;s40;/rC:-2.5872,.2047,.04;-3.7432,.328,.4216;.1966,-.0946,-.9026;-1.9609,-1.1444,-.063;-1.7729,1.4018,-.3161;-.4366,1.2941,-.7739;-.6298,-1.324,-.5134;-2.3439,2.6722,-.1777;-1.5847,3.7896,-.4871;-.2662,3.5972,-.9274;.2955,2.4085,-1.0703;-3.3748,2.7472,.1757;-1.9886,4.7987,-.3915;.3565,4.4653,-1.1727;-.7987,-3.6123,-.2107;-2.1248,-3.5209,.2393;-2.7088,-2.2662,.3129;-.0719,-2.5692,-.5751;-3.7345,-2.1197,.6589;-.3126,-4.5929,-.2721;-2.6699,-4.422,.5244;1.6637,-.2454,-1.3316;3.6629,-1.1253,-1.7846;3.7624,.2302,-1.9194;4.4089,-1.902,-1.9181;4.611,.8495,-2.1914;2.5201,.7463,-1.6387;2.158,1.7105,-1.6;2.3631,-1.3912,-1.4261;1.8662,-2.2665,-1.2047;1.5307,.191,2.9456;1.9476,-1.1007,2.4544;3.0466,-1.175,2.4726;1.5476,-1.8974,3.1009;1.6068,-1.3121,1.417;.0937,.3086,3.0393;-.3111,-.4935,3.6755;-.1781,1.2716,3.4986;-.4173,.2484,2.054;2.1274,1.2843,2.2163;1.86,2.243,2.6877;3.2254,1.1966,2.2355;1.806,1.3361,1.1527; 0.000000 1.223580 0.000000 2.954214 4.177768 0.000000 1.490944 2.362019 2.542011 0.000000 1.490951 2.362070 2.542071 2.565676 0.000000 2.544424 3.646373 1.531611 2.962264 1.416653 0.000000 2.544494 3.646396 1.531606 1.416669 2.962375 2.638060 0.000000 2.488990 2.795102 3.825530 3.837482 1.399657 2.427455 4.361229 0.000000 3.759522 4.179418 4.293286 4.966433 2.401245 2.761876 5.202016 1.385872 0.000000 4.222755 4.959539 3.720749 5.108999 2.731929 2.314513 4.951922 2.394684 1.403325 0.000000 3.794645 4.781793 2.510594 4.327701 2.420871 1.365923 3.885545 2.798761 2.404787 1.322535 0.000000 2.665132 2.459461 4.689656 4.147342 2.148904 3.412632 4.958234 1.092312 2.174880 3.406224 3.890808 0.000000 4.652878 4.871084 5.383319 5.952231 3.404539 3.851902 6.272813 2.166563 1.091120 2.167303 3.375068 2.540073 0.000000 5.318727 6.038805 4.570712 6.170171 3.827958 3.293179 5.909629 3.390818 2.166802 1.096189 2.060339 4.323481 2.494115 0.000000 4.222737 4.959423 3.720736 2.731917 5.109031 4.951881 2.314462 6.471812 7.448665 7.264609 6.179495 6.872355 8.496708 8.216375 0.000000 3.759454 4.179228 4.293252 2.401217 4.966412 5.201928 2.761840 6.210960 7.366266 7.448637 6.536802 6.391806 8.344558 8.481153 1.403350 0.000000 2.488932 2.794922 3.825508 1.399671 3.837461 4.361138 2.427481 4.976127 6.210972 6.471790 5.726406 5.059324 7.136387 7.544326 2.394716 1.385861 0.000000 3.794702 4.781781 2.510629 2.420905 4.327807 3.885570 1.365917 5.726488 6.536883 6.179542 5.015738 6.303733 7.615358 7.072903 1.322516 2.404807 2.798827 0.000000 2.664963 2.459127 4.689581 2.148880 4.147197 4.958049 3.412641 5.059205 6.391704 6.872228 6.303557 4.904013 7.212173 7.965740 3.406310 2.174955 1.092328 3.890888 0.000000 5.318717 6.038679 4.570756 3.827953 6.170232 5.909642 3.293156 7.544369 8.481212 8.216422 7.072916 7.965875 9.540746 9.127478 1.096196 2.166801 3.390829 2.060346 4.323555 0.000000 4.652795 4.870862 5.383281 3.404508 5.952197 6.272719 3.851859 7.136367 8.344553 8.496678 7.615277 7.212267 9.291149 9.540690 2.167317 1.091114 2.166537 3.375071 2.540163 2.494089 0.000000 4.489315 5.712874 1.535988 3.944056 3.943965 2.663116 2.663296 5.089668 5.248438 4.318929 2.997137 6.050910 6.298029 4.891285 4.319305 5.248746 5.089885 2.997518 6.051052 4.891778 6.298357 0.000000 6.645421 7.863165 3.722322 5.881465 6.171785 4.866287 4.481386 7.285941 7.305945 6.202785 4.933215 8.268469 8.305003 6.523939 5.344932 6.582716 6.804374 4.182906 7.853672 5.487833 7.503588 2.230752 0.000000 6.645051 7.862772 3.722126 6.171845 5.880709 4.480563 4.866567 6.803220 6.581196 5.343257 4.181478 7.852609 7.501923 5.485813 6.203845 7.306756 7.286345 4.934118 8.268709 6.525390 8.305944 2.230695 1.365768 0.000000 7.564284 8.769514 4.694907 6.677629 7.190080 5.916376 5.262749 8.339881 8.388432 7.285585 6.018210 9.305120 9.389233 7.584253 5.741084 7.068581 7.468079 4.725156 8.544198 5.678296 7.901014 3.259577 1.085218 2.228044 0.000000 7.563660 8.768835 4.694626 7.189988 6.676562 5.261701 5.916574 7.466494 7.066540 5.738912 4.723412 8.542670 7.898749 5.675668 7.286680 8.389218 8.340168 6.019117 9.305198 7.585825 9.390179 3.259524 2.228015 1.085225 2.772365 0.000000 5.403292 6.606696 2.578304 5.112438 4.539697 3.128891 3.933736 5.431586 5.238036 4.049314 2.834498 6.484196 6.189106 4.327750 5.661381 6.581064 6.342325 4.340802 7.253410 6.196678 7.637173 1.345768 2.197768 1.374211 3.264874 2.165202 0.000000 5.241545 6.389236 2.755339 5.241979 4.146782 2.754608 4.261538 4.818207 4.423690 3.144650 2.058269 5.902483 5.309542 3.319205 6.245381 7.006598 6.569555 4.933469 7.381991 6.899282 8.088849 2.035125 3.215663 2.206217 4.268266 2.666161 1.030663 0.000000 5.403891 6.607316 2.578622 4.540518 5.112745 3.933792 3.129729 6.342421 6.580880 5.660969 4.340405 7.253670 7.636929 6.195987 4.050614 5.239281 5.432666 2.835711 6.485223 4.329165 6.190399 1.345795 1.374293 2.197774 2.165272 3.264886 2.153825 3.113378 0.000000 5.243012 6.390753 2.756143 4.148461 5.243072 4.262210 2.756178 6.570469 7.007157 6.245584 4.933605 7.383147 8.089365 6.899146 3.146589 4.425679 4.820145 2.060201 5.904413 3.320987 5.311506 2.035248 2.206062 3.215521 2.665952 4.268110 3.113363 4.007254 1.030548 0.000000 5.039810 5.848387 4.082832 4.798541 4.797822 4.349874 4.350516 5.560985 5.868487 5.461831 4.750811 6.186318 6.689746 6.050561 5.463786 5.870607 5.562547 4.752089 6.187871 6.052800 6.692289 4.301429 5.352851 5.352513 6.026555 6.025820 4.722547 4.833705 4.723102 4.834874 0.000000 5.300758 6.209593 3.917616 4.649298 5.270776 4.673452 3.937101 6.291283 6.711507 6.197409 5.240894 6.951736 7.641679 6.831401 4.577502 5.229592 5.256119 3.926003 6.045515 4.973754 6.006487 3.891818 4.572965 4.918790 5.081222 5.699168 4.526855 4.938144 3.913513 3.841186 1.443355 0.000000 6.289803 7.250382 4.547774 5.613034 6.135619 5.363694 4.738649 7.133294 7.406520 6.731229 5.741273 7.867299 8.321157 7.234556 5.284650 6.102023 6.243424 4.578034 7.082758 5.522693 6.856944 4.153214 4.301893 4.666533 4.654305 5.319698 4.568540 5.069739 3.964122 4.013396 2.094638 1.101692 0.000000 5.557383 6.334328 4.593803 4.784019 5.795430 5.397803 4.258252 6.839203 7.417996 7.050378 6.124283 7.372854 8.339002 7.756718 4.405972 4.930592 5.101544 4.072755 5.823471 4.701391 5.549711 4.731784 5.379450 5.885125 5.777289 6.703598 5.513463 5.957169 4.627624 4.333066 2.094179 1.101234 1.778679 0.000000 4.667583 5.683585 2.975123 3.866141 4.668155 3.970816 2.954454 5.833177 6.311749 5.753737 4.663519 6.544819 7.317023 6.453551 3.704975 4.493367 4.555615 2.892595 5.454888 4.159430 5.362693 2.948896 3.809538 4.261028 4.395752 5.168968 3.795806 4.306053 2.943042 2.802017 2.145088 1.112262 1.790639 1.783702 0.000000 4.024158 4.644865 3.963788 3.994612 3.992307 3.974007 3.976224 4.677386 5.231597 5.165204 4.619422 5.116376 6.022217 5.923552 5.170375 5.237046 4.681559 4.623177 5.120313 5.929224 6.028384 4.677278 6.169726 6.168798 6.934261 6.932493 5.287968 5.267827 5.289603 5.271114 1.444890 2.401102 3.352953 2.642767 2.747389 0.000000 4.345630 4.800180 4.623329 4.137789 4.654250 4.796632 4.282214 5.385267 6.106851 6.158121 5.595687 5.668910 6.881969 6.967107 5.006675 4.925570 4.494209 4.736379 4.843862 5.691072 5.561134 5.388164 6.782639 6.958397 7.453217 7.775052 6.147595 6.227744 5.829533 5.630272 2.096109 2.638477 3.631247 2.399157 3.073951 1.100898 0.000000 4.347837 4.802966 4.623484 4.658317 4.136734 4.280309 4.799619 4.490877 4.919811 5.000584 4.731962 4.841283 5.554399 5.683907 6.164090 6.113890 5.391542 5.599811 5.675548 6.973379 6.889983 5.387373 6.957704 6.779797 7.775087 7.449128 5.826418 5.625420 6.148210 6.230362 2.096065 3.352045 4.175759 3.630198 3.767472 1.100899 1.778889 0.000000 2.960885 3.705826 3.039075 2.967237 2.964122 3.015112 3.018126 3.816764 4.512230 4.486249 3.864648 4.303379 5.399529 5.365930 4.492186 4.518427 3.821763 3.869223 4.307877 5.372178 5.406212 4.004615 5.768010 5.766959 6.610165 6.608247 4.744698 4.703387 4.746622 4.707265 2.143078 2.751911 3.768300 3.092099 2.633969 1.111520 1.786245 1.786252 0.000000 5.303666 6.212835 3.918742 5.273303 4.651826 3.938932 4.675052 5.258355 5.231097 4.578418 3.926980 6.047962 6.007711 4.973974 6.199109 6.714072 6.294234 5.242007 6.955094 6.832784 7.644496 3.891338 4.916405 4.570361 5.696564 5.077956 3.912089 3.840157 4.525613 4.937544 1.443330 2.403532 2.637961 3.352865 2.766045 2.401074 3.352019 2.638075 2.752201 0.000000 5.562541 6.340193 4.595732 5.799948 4.788366 4.261098 5.400794 5.105654 4.933264 4.407240 4.073984 5.828118 5.551975 4.701279 7.053600 7.422551 6.844386 6.126603 7.378744 7.759461 8.343945 4.731271 5.881903 5.375442 6.700044 5.771982 4.625256 4.330890 5.512145 5.956977 2.094182 3.352875 3.624465 4.172615 3.783774 2.642915 3.630098 2.398908 3.092823 1.101240 0.000000 6.292084 7.253027 4.548447 6.136871 5.615729 4.740900 5.363970 6.246492 6.105186 5.287584 4.580516 7.085870 6.860150 5.525503 6.730743 7.407000 7.134564 5.740517 7.869103 7.233511 8.321732 4.152410 4.663020 4.299461 5.315453 4.651691 3.963517 4.014304 4.565947 5.067069 2.094622 2.637800 2.390103 3.624447 3.095688 3.352946 4.175765 3.631056 3.768432 1.101693 1.778683 0.000000 4.671050 5.687280 2.976800 4.671263 3.869243 2.956860 3.973042 4.558264 4.495107 3.705950 2.893703 5.457734 5.364091 4.159462 5.755886 6.314709 5.836566 4.665156 6.548522 6.455348 7.320148 2.948403 4.258395 3.806302 5.166212 4.391797 2.941003 2.800279 3.794585 4.305745 2.145086 2.766244 3.096241 3.783837 2.668749 2.747201 3.767502 3.073097 2.634123 1.112266 1.783662 1.790651 0.000000 0.2665889 0.2415357 0.1870063 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 454 454 454 454 454 MxSgAt= 43 MxSgA2= 43. NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 454 454 454 454 454 MxSgAt= 43 MxSgA2= 43. 1 0.7801 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 C O B C C C C C C C N H H H C C C N H H H C C C H H N H N H N C H H H C H H H C H H H 13 17 11 13 13 13 13 13 13 13 14 1 1 1 13 13 13 14 1 1 1 13 13 13 1 1 14 1 14 1 14 13 1 1 1 13 1 1 1 13 1 1 1 -0.01851 0.05453 0.04177 0.01892 0.01914 -0.03370 -0.03384 -0.01769 0.02033 -0.01724 0.02402 0.00083 -0.00162 0.00080 -0.01711 0.02020 -0.01754 0.02394 0.00082 0.00079 -0.00161 -0.03315 -0.00117 -0.00080 -0.00034 -0.00036 0.02482 -0.00133 0.02500 -0.00133 0.00218 -0.00010 0.00002 0.00003 0.00015 0.00295 0.00006 0.00009 0.00005 -0.00006 0.00001 0.00007 0.00016 -20.80566 -33.05353 59.90850 21.27146 21.51523 -37.88402 -38.03835 -19.88631 22.85901 -19.37678 7.76244 3.70422 -7.23000 3.58115 -19.24051 22.70306 -19.71929 7.73419 3.68114 3.54355 -7.18528 -37.26877 -1.31854 -0.89653 -1.52606 -1.62750 8.02089 -5.94739 8.07669 -5.92668 0.70597 -0.11594 0.07779 0.11560 0.67830 3.31342 0.27973 0.40777 0.24119 -0.06546 0.05492 0.32972 0.69840 -7.42398 -11.79432 21.37684 7.59019 7.67717 -13.51796 -13.57303 -7.09593 8.15666 -6.91412 2.76983 1.32176 -2.57984 1.27784 -6.86549 8.10102 -7.03633 2.75975 1.31352 1.26443 -2.56389 -13.29842 -0.47049 -0.31991 -0.54453 -0.58073 2.86205 -2.12218 2.88196 -2.11479 0.25191 -0.04137 0.02776 0.04125 0.24203 1.18231 0.09981 0.14550 0.08606 -0.02336 0.01960 0.11765 0.24921 -6.94002 -11.02547 19.98333 7.09540 7.17671 -12.63675 -12.68823 -6.63336 7.62494 -6.46340 2.58927 1.23559 -2.41167 1.19454 -6.41794 7.57293 -6.57765 2.57985 1.22789 1.18200 -2.39675 -12.43152 -0.43982 -0.29905 -0.50904 -0.54287 2.67548 -1.98384 2.69409 -1.97693 0.23549 -0.03867 0.02595 0.03856 0.22626 1.10524 0.09331 0.13602 0.08045 -0.02184 0.01832 0.10998 0.23296 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 0.014858 -0.221006 -0.099063 -0.043172 -0.044369 0.010153 0.009836 0.020390 -0.045301 0.023444 -0.069624 -0.003360 -0.006052 0.000029 0.025473 -0.043926 0.020312 -0.067671 -0.002828 0.001580 -0.002831 0.010008 -0.006532 -0.007296 0.001007 0.002448 -0.079152 -0.003187 -0.080252 -0.000946 -0.001697 -0.000107 0.000455 -0.000101 0.001172 -0.004120 -0.001278 -0.000914 -0.004222 -0.000947 -0.000730 0.000040 -0.000798 -0.004408 -0.287199 -0.125593 -0.060080 -0.060307 0.013760 0.015206 0.035731 -0.054249 0.034907 -0.080556 0.006453 0.007095 0.001985 0.031505 -0.054764 0.034919 -0.079479 0.005750 0.000143 0.003210 0.004887 -0.010964 -0.012327 0.000565 -0.001051 -0.094268 0.007814 -0.092153 0.005393 -0.002496 -0.001606 -0.000965 -0.000735 -0.002309 -0.005280 -0.000634 -0.001330 -0.005732 -0.001184 -0.000226 -0.000453 -0.000218 -0.010450 0.508205 0.224656 0.103252 0.104676 -0.023912 -0.025042 -0.056121 0.099550 -0.058351 0.150180 -0.003092 -0.001043 -0.002014 -0.056979 0.098690 -0.055231 0.147150 -0.002922 -0.001723 -0.000379 -0.014895 0.017495 0.019623 -0.001572 -0.001397 0.173421 -0.004627 0.172405 -0.004447 0.004193 0.001713 0.000510 0.000836 0.001137 0.009400 0.001911 0.002244 0.009953 0.002131 0.000956 0.000413 0.001015 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 -0.003129 0.009495 0.004242 0.004127 -0.000323 0.001042 -0.001675 0.000405 -0.001499 -0.004480 0.001654 0.000186 -0.004880 -0.003092 0.002448 0.006521 -0.000582 0.006151 0.002181 0.002986 0.007514 -0.001263 -0.000468 0.000115 -0.002900 0.002375 0.003682 -0.002772 0.000975 0.004974 0.000366 -0.000340 -0.000007 -0.000449 -0.001063 0.000443 -0.000091 -0.000440 -0.000017 0.000795 0.000376 0.000698 0.002289 -0.007751 0.235069 0.095164 0.050860 0.051817 -0.010303 -0.009771 -0.025465 0.048309 -0.026503 0.064453 0.000098 0.001765 -0.000620 -0.027156 0.046794 -0.025403 0.066424 -0.000194 -0.001338 0.000192 -0.008555 0.005339 0.005717 -0.000370 -0.000956 0.049765 -0.000566 0.051580 -0.001520 0.002300 0.001531 0.001200 0.001065 0.002880 0.003672 0.000504 0.000053 0.000239 0.001766 0.000696 0.001007 0.002588 0.000589 0.031293 0.016679 0.008650 0.004169 -0.003511 -0.000750 -0.001593 0.002550 0.000053 0.004404 -0.000256 0.001331 0.000821 -0.007943 0.010094 -0.006571 0.016431 -0.001190 -0.001021 -0.002492 -0.000413 0.002205 0.001259 0.000459 -0.000506 0.010327 0.000049 0.021115 -0.001694 0.001377 0.000108 0.000042 -0.000615 -0.000655 0.001667 -0.001037 0.000691 -0.001305 0.001313 0.001389 0.000859 0.002962 0.2749 0.0356 0.9608 0.1281 0.989 -0.0733 0.9529 -0.1433 -0.2673 -0.0126 -0.0049 0.0175 -1.697 -0.652 2.349 -0.605 -0.233 0.838 -0.566 -0.217 0.783 1 C 13 0.9504 -0.1468 -0.2741 0.1304 0.9884 -0.0773 0.2822 0.0377 0.9586 -0.2903 -0.2884 0.5786 21.003 20.868 -41.871 7.494 7.446 -14.94 7.006 6.961 -13.967 2 O 17 0.1734 0.9804 -0.0936 0.9493 -0.1917 -0.2493 0.2623 0.0456 0.9639 -0.1264 -0.1249 0.2513 -21.648 -21.386 43.034 -7.724 -7.631 15.356 -7.221 -7.134 14.355 3 B 11 -0.5004 0.8589 0.1094 0.8126 0.5095 -0.2831 0.2989 0.0527 0.9528 -0.0614 -0.0583 0.1197 -8.237 -7.824 16.061 -2.939 -2.792 5.731 -2.748 -2.61 5.357 4 C 13 0.694 0.6813 -0.2327 -0.655 0.7317 0.1888 0.2989 0.0214 0.954 -0.0621 -0.0589 0.121 -8.328 -7.91 16.237 -2.972 -2.822 5.794 -2.778 -2.638 5.416 5 C 13 0.2643 0.076 0.9614 0.7724 -0.6136 -0.1639 0.5775 0.7859 -0.2209 -0.027 0.0115 0.0155 -3.626 1.545 2.082 -1.294 0.551 0.743 -1.21 0.515 0.694 6 C 13 0.2534 0.0268 0.967 0.8907 0.3835 -0.2441 -0.3774 0.9232 0.0733 -0.0276 0.0118 0.0158 -3.707 1.582 2.124 -1.323 0.565 0.758 -1.236 0.528 0.709 7 C 13 0.2893 0.0141 0.9571 0.952 -0.1088 -0.2861 0.1001 0.994 -0.0449 -0.0638 0.028 0.0358 -8.567 3.757 4.81 -3.057 1.341 1.716 -2.858 1.253 1.604 8 C 13 0.9051 0.3216 -0.278 -0.3111 0.9468 0.0824 0.2897 0.0119 0.957 -0.0607 -0.0535 0.1142 -8.142 -7.184 15.325 -2.905 -2.563 5.469 -2.716 -2.396 5.112 9 C 13 0.284 0.0121 0.9587 0.7972 0.5527 -0.2431 -0.5328 0.8333 0.1473 -0.0662 0.0284 0.0378 -8.884 3.814 5.07 -3.17 1.361 1.809 -2.963 1.272 1.691 10 C 13 0.9632 -0.0676 -0.2603 0.0603 0.9975 -0.0359 0.2621 0.0189 0.9649 -0.0872 -0.0806 0.1678 -3.362 -3.109 6.471 -1.199 -1.109 2.309 -1.121 -1.037 2.158 11 N 14 0.9455 -0.0263 -0.3246 0.3252 0.0191 0.9455 0.0186 0.9995 -0.0266 -0.0034 -0.0031 0.0065 -1.814 -1.634 3.448 -0.647 -0.583 1.23 -0.605 -0.545 1.15 12 H 1 0.908 0.3125 -0.2791 0.2883 0.0175 0.9574 -0.3041 0.9498 0.0742 -0.0083 -5.0E-4 0.0088 -4.415 -0.26 4.675 -1.575 -0.093 1.668 -1.473 -0.087 1.559 13 H 1 0.8053 0.5431 0.2379 -0.1036 -0.2662 0.9583 -0.5838 0.7964 0.1581 -0.0022 -0.0022 0.0044 -1.195 -1.16 2.355 -0.426 -0.414 0.84 -0.399 -0.387 0.786 14 H 1 0.2832 0.0711 0.9564 -0.6323 0.7637 0.1305 0.7211 0.6417 -0.2612 -0.0656 0.0281 0.0375 -8.804 3.774 5.031 -3.142 1.347 1.795 -2.937 1.259 1.678 15 C 13 0.7928 -0.5769 -0.1967 0.5377 0.814 -0.2198 0.2869 0.0685 0.9555 -0.0603 -0.0532 0.1135 -8.089 -7.136 15.226 -2.886 -2.546 5.433 -2.698 -2.38 5.079 16 C 13 0.2902 0.0655 0.9547 0.945 -0.177 -0.2751 0.151 0.982 -0.1133 -0.0634 0.0278 0.0356 -8.508 3.732 4.776 -3.036 1.332 1.704 -2.838 1.245 1.593 17 C 13 0.9415 -0.2242 -0.2515 0.1974 0.972 -0.1278 0.2731 0.0707 0.9594 -0.0869 -0.0804 0.1673 -3.351 -3.1 6.451 -1.196 -1.106 2.302 -1.118 -1.034 2.152 18 N 14 0.9256 -0.2574 -0.2775 0.3006 0.0542 0.9522 0.2301 0.9648 -0.1276 -0.0034 -0.0031 0.0064 -1.802 -1.628 3.429 -0.643 -0.581 1.224 -0.601 -0.543 1.144 19 H 1 0.634 -0.5777 0.5142 -0.1532 0.5579 0.8157 0.758 0.5959 -0.2652 -0.0022 -0.0022 0.0044 -1.188 -1.158 2.346 -0.424 -0.413 0.837 -0.396 -0.386 0.782 20 H 1 0.7983 -0.5681 -0.2 0.2854 0.0645 0.9562 0.5303 0.8205 -0.2136 -0.0082 -5.0E-4 0.0087 -4.389 -0.261 4.65 -1.566 -0.093 1.659 -1.464 -0.087 1.551 21 H 1 0.2975 0.0343 0.9541 0.1197 0.9901 -0.0729 0.9472 -0.1358 -0.2904 -0.0176 0.0048 0.0128 -2.359 0.639 1.719 -0.842 0.228 0.613 -0.787 0.213 0.573 22 C 13 0.2226 0.9681 -0.1153 0.9532 -0.2409 -0.1828 0.2047 0.0692 0.9764 -0.0113 -0.0074 0.0188 -1.521 -0.998 2.519 -0.543 -0.356 0.899 -0.507 -0.333 0.84 23 C 13 0.027 0.9987 -0.0441 0.9796 -0.0352 -0.1979 0.1992 0.0379 0.9792 -0.0124 -0.0085 0.0208 -1.661 -1.135 2.796 -0.593 -0.405 0.998 -0.554 -0.378 0.933 24 C 13 0.6579 0.7345 -0.1664 0.1925 0.0495 0.98 0.7281 -0.6768 -0.1089 -0.0021 -0.0016 0.0038 -1.14 -0.865 2.005 -0.407 -0.309 0.715 -0.38 -0.289 0.669 25 H 1 -0.4458 0.8946 0.0306 0.1935 0.0629 0.9791 0.874 0.4424 -0.2011 -0.0023 -0.0016 0.0039 -1.202 -0.863 2.065 -0.429 -0.308 0.737 -0.401 -0.288 0.689 26 H 1 -0.2533 0.9673 0.0097 0.9492 0.2504 -0.1905 0.1867 0.039 0.9816 -0.0951 -0.0882 0.1833 -3.669 -3.4 7.069 -1.309 -1.213 2.522 -1.224 -1.134 2.358 27 N 14 0.4445 0.0934 0.8909 0.8652 0.2126 -0.454 -0.2319 0.9727 0.0137 -0.0049 -0.0036 0.0085 -2.617 -1.905 4.522 -0.934 -0.68 1.614 -0.873 -0.636 1.508 28 H 1 0.4898 0.8567 -0.1618 0.8506 -0.5103 -0.1269 0.1912 0.0755 0.9786 -0.0956 -0.0885 0.1841 -3.686 -3.414 7.101 -1.315 -1.218 2.534 -1.23 -1.139 2.369 29 N 14 0.3862 -0.0345 0.9218 0.7875 -0.508 -0.349 0.4803 0.8607 -0.169 -0.005 -0.0035 0.0085 -2.678 -1.858 4.536 -0.956 -0.663 1.619 -0.893 -0.62 1.513 30 H 1 0.2441 0.933 -0.2644 0.9162 -0.3112 -0.2525 0.3179 0.1806 0.9308 -0.0028 -0.0025 0.0052 -0.108 -0.095 0.202 -0.038 -0.034 0.072 -0.036 -0.032 0.067 31 N 14 0.3615 0.9133 -0.1878 0.7895 -0.407 -0.4594 0.496 -0.0178 0.8681 -0.0018 -8.0E-4 0.0026 -0.237 -0.11 0.347 -0.084 -0.039 0.124 -0.079 -0.037 0.116 32 C 13 0.0895 0.9909 -0.1006 0.7097 -0.1343 -0.6915 0.6988 0.0095 0.7153 -0.001 -7.0E-4 0.0017 -0.517 -0.38 0.898 -0.185 -0.136 0.32 -0.173 -0.127 0.3 33 H 1 0.3299 0.9359 0.1238 0.7835 -0.1983 -0.5889 0.5265 -0.2913 0.7987 -0.001 -8.0E-4 0.0018 -0.52 -0.421 0.94 -0.185 -0.15 0.336 -0.173 -0.14 0.314 34 H 1 0.3317 0.939 -0.0905 -0.6286 0.2915 0.721 0.7034 -0.1823 0.687 -0.0026 -0.0016 0.0043 -1.399 -0.874 2.273 -0.499 -0.312 0.811 -0.467 -0.292 0.758 35 H 1 -0.0702 0.9931 -0.094 0.967 0.0446 -0.2508 0.2449 0.1085 0.9635 -0.0055 -0.0051 0.0105 -0.734 -0.678 1.412 -0.262 -0.242 0.504 -0.245 -0.226 0.471 36 C 13 0.9663 -0.1622 -0.1998 0.2173 0.9303 0.2955 0.138 -0.3289 0.9342 -0.0014 -0.001 0.0024 -0.729 -0.525 1.254 -0.26 -0.187 0.448 -0.243 -0.175 0.418 37 H 1 0.4875 0.8589 -0.1568 0.8731 -0.4777 0.0976 -0.009 0.1845 0.9828 -0.0017 -7.0E-4 0.0024 -0.91 -0.356 1.266 -0.325 -0.127 0.452 -0.304 -0.119 0.422 38 H 1 -0.0017 0.9966 0.0824 0.9999 0.003 -0.0165 0.0167 -0.0824 0.9965 -0.0058 -0.0042 0.0101 -3.116 -2.255 5.37 -1.112 -0.805 1.916 -1.039 -0.752 1.791 39 H 1 0.7801 -0.609 -0.1435 0.4785 0.7285 -0.4902 0.4031 0.3137 0.8597 -0.0019 -0.0015 0.0034 -0.254 -0.207 0.461 -0.091 -0.074 0.165 -0.085 -0.069 0.154 40 C 13 0.2879 0.7553 -0.5888 0.9192 -0.3905 -0.0515 0.2688 0.5263 0.8067 -0.0012 -9.0E-4 0.0021 -0.622 -0.495 1.117 -0.222 -0.177 0.399 -0.207 -0.165 0.373 41 H 1 -0.2381 0.8959 -0.375 0.7849 -0.0499 -0.6176 0.5721 0.4414 0.6913 -0.001 -8.0E-4 0.0018 -0.532 -0.425 0.958 -0.19 -0.152 0.342 -0.178 -0.142 0.32 42 H 1 2.31377212e+00 -4.01390069e-01 -8.23286016e-01 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 6 8 5 6 6 6 6 6 6 6 7 1 1 1 6 6 6 7 1 1 1 6 6 6 1 1 7 1 7 1 7 6 1 1 1 6 1 1 1 6 1 1 1 -0.009740999 0.001477644 0.002839022 0.012231564 -0.001857667 -0.003539246 -0.000291369 0.000064529 0.000053997 -0.000951851 0.001357045 0.000243255 -0.001261879 -0.001023459 0.000407893 0.000109638 -0.000261294 -0.000023986 0.000188114 0.000211446 -0.000049676 -0.000067885 0.000433371 0.000011304 -0.000217466 -0.000137400 0.000066187 0.000152603 -0.000035966 -0.000046679 -0.000057118 0.000011381 0.000010630 0.000010541 -0.000038735 -0.000004157 -0.000009987 -0.000010519 0.000001656 0.000006674 -0.000007688 -0.000001145 0.000154319 -0.000015382 -0.000044442 -0.000174815 0.000193118 0.000040262 -0.000174825 -0.000386484 0.000075165 -0.000063624 0.000001282 -0.000010654 0.000015862 0.000039413 -0.000007697 0.000006181 0.000005528 -0.000001680 -0.000008104 0.000014068 0.000002605 0.000333946 -0.000073728 -0.000121673 -0.000106996 0.000043231 0.000001305 -0.000087031 0.000044775 -0.000001269 -0.000006351 -0.000004646 -0.000016814 0.000003831 0.000003982 0.000027751 0.000022545 -0.000194496 0.000123324 -0.000032520 -0.000015520 0.000085838 0.000062909 0.000223893 -0.000099425 0.000021644 -0.000066937 0.000043430 0.000039602 -0.000049610 -0.000050035 0.000021433 0.000061322 -0.000020361 0.000020733 -0.000049425 -0.000006772 -0.000021290 0.000011611 0.000014208 -0.000100309 -0.000046397 0.000005507 -0.000081208 0.000142221 -0.000016425 -0.000037312 0.000034760 0.000053016 0.000005611 0.000039145 -0.000065479 0.000086823 -0.000193761 0.000054821 0.000136131 -0.000014411 0.000073607 0.000023694 0.000013458 0.000010619 0.000008065 -0.000014614 -0.000015141 -0.000169524 0.000070913 -0.000102646 0.012231564 0.001467060 (Enter /NFS_R1/Userdata/grufor/SOFTWARE/g16/l716.exe) 0.7797 0.7796 0.7794 0.7794 0.7794 0.7794 0.7795 0.7796 0.7796 0.7797 0.7797 0.7797 0.7796 0.7795 0.7790 0.7793 0.7787 0.7791 0.7981 0.7796 0.7802 0.7797 0.7799 0.7798 0.7798 0.7798 0.7798 0.7798 0.7798 0.7797 0.7797 0.7797 0.7798 0.7798 0.7798 0.7798 0.7798 0.7798 0.7798 0.7798 0.7798 0.7798 open 1 1 1 -1032.03586895685 -1032.03586925081 -0.000000293964 -1032.03586926964 -0.000000018829 -1032.03586927037 -0.000000000726 -1032.03586927084 -0.000000000470 -1032.03586927091 -0.000000000071 -1032.03586927089 0.000000000022 -1032.03586927 7 0.7798 1.021172374366e+03 -6.464213565694e+03 2.376871050586e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 1572864000 LenX= 1572439727 LenY= 1572232247 Requested convergence on RMS density matrix=1.00D-08 within 32 cycles. Requested convergence on MAX density matrix=1.00D-06. Requested convergence on energy=1.00D-06. No special actions if energy rises. Fock matrices will be formed incrementally for 20 cycles. 0.7798 (Enter /NFS_R1/Userdata/grufor/SOFTWARE/g16/l716.exe) 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 C O B C C C C C C C N H H H C C C N H H H C C C H H N H N H N C H H H C H H H C H H H 13 17 11 13 13 13 13 13 13 13 14 1 1 1 13 13 13 14 1 1 1 13 13 13 1 1 14 1 14 1 14 13 1 1 1 13 1 1 1 13 1 1 1 -0.01828 0.05335 0.04186 0.01915 0.01915 -0.03391 -0.03392 -0.01771 0.02043 -0.01733 0.02417 0.00083 -0.00163 0.00080 -0.01732 0.02042 -0.01771 0.02418 0.00083 0.00080 -0.00163 -0.03302 -0.00105 -0.00106 -0.00034 -0.00034 0.02468 -0.00132 0.02468 -0.00132 0.00242 0.00097 0.00003 0.00006 0.00014 0.00021 0.00004 0.00004 0.00015 0.00094 0.00006 0.00003 0.00014 -20.54828 -32.33809 60.03998 21.52521 21.53077 -38.11580 -38.13202 -19.90916 22.96268 -19.47975 7.80994 3.70342 -7.27029 3.59057 -19.47541 22.95821 -19.90505 7.81222 3.70320 3.58888 -7.26825 -37.11904 -1.17489 -1.19120 -1.51393 -1.50909 7.97564 -5.91900 7.97402 -5.91989 0.78074 1.08892 0.14080 0.28052 0.63951 0.23465 0.20065 0.19971 0.66595 1.05341 0.27829 0.13615 0.61895 -7.33214 -11.53904 21.42376 7.68073 7.68272 -13.60067 -13.60645 -7.10408 8.19365 -6.95086 2.78678 1.32147 -2.59422 1.28121 -6.94931 8.19206 -7.10262 2.78759 1.32139 1.28060 -2.59349 -13.24500 -0.41923 -0.42505 -0.54021 -0.53848 2.84591 -2.11205 2.84533 -2.11237 0.27859 0.38855 0.05024 0.10010 0.22819 0.08373 0.07160 0.07126 0.23763 0.37588 0.09930 0.04858 0.22086 -6.85417 -10.78683 20.02718 7.18004 7.18189 -12.71406 -12.71947 -6.64098 7.65952 -6.49775 2.60511 1.23533 -2.42511 1.19769 -6.49630 7.65803 -6.63961 2.60587 1.23525 1.19712 -2.42443 -12.38158 -0.39190 -0.39734 -0.50499 -0.50338 2.66039 -1.97437 2.65985 -1.97466 0.26043 0.36322 0.04696 0.09357 0.21332 0.07827 0.06693 0.06661 0.22214 0.35138 0.09283 0.04542 0.20646 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 0.014271 -0.198736 -0.088594 -0.039501 -0.040203 0.009138 0.008699 0.018238 -0.041562 0.021782 -0.064154 -0.003317 -0.005434 0.000280 0.022780 -0.040265 0.018056 -0.063324 -0.003007 0.001194 -0.003556 0.008773 -0.005797 -0.005682 0.001280 0.002048 -0.071158 -0.002809 -0.071509 -0.001680 -0.001156 -0.001683 0.000371 -0.000692 -0.001204 -0.001395 -0.000885 -0.000892 -0.001461 -0.001477 -0.000584 0.000515 -0.000404 -0.004796 -0.278251 -0.124531 -0.059866 -0.060092 0.014090 0.014989 0.035629 -0.054516 0.034528 -0.081073 0.006404 0.006654 0.001710 0.031735 -0.054180 0.034697 -0.079005 0.005865 0.000358 0.003859 0.004466 -0.011098 -0.011351 0.000239 -0.000797 -0.093039 0.007408 -0.090610 0.005815 -0.002137 -0.002746 -0.001145 -0.000599 -0.001776 -0.002437 -0.001159 -0.000881 -0.004027 -0.002583 -0.000213 -0.001050 -0.001215 -0.009475 0.476987 0.213125 0.099368 0.100295 -0.023228 -0.023688 -0.053867 0.096078 -0.056310 0.145226 -0.003087 -0.001220 -0.001991 -0.054515 0.094446 -0.052753 0.142329 -0.002858 -0.001552 -0.000303 -0.013239 0.016895 0.017034 -0.001519 -0.001251 0.164197 -0.004599 0.162119 -0.004135 0.003293 0.004429 0.000773 0.001291 0.002979 0.003832 0.002044 0.001773 0.005487 0.004061 0.000796 0.000535 0.001619 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 -0.002298 0.019172 0.008215 0.006607 0.001650 0.000788 -0.002263 -0.000844 -0.000215 -0.005445 0.003265 -0.000346 -0.005459 -0.003151 0.001102 0.008749 -0.002200 0.009007 0.001736 0.002976 0.007144 -0.001284 -0.000020 0.000527 -0.002826 0.002363 0.006097 -0.003298 0.003786 0.004399 0.000105 -0.000411 -0.000469 -0.000255 -0.002314 0.000032 0.000018 -0.000013 -0.000286 0.000836 0.000464 0.000521 0.002991 -0.008835 0.255230 0.110723 0.057077 0.057258 -0.011911 -0.011496 -0.028271 0.053738 -0.029646 0.074555 0.000119 0.001937 -0.000719 -0.030952 0.053405 -0.028533 0.075012 -0.000175 -0.001495 0.000333 -0.009643 0.006855 0.006689 -0.000547 -0.001166 0.065599 -0.000630 0.066604 -0.001567 0.001806 0.002989 0.001423 0.000796 0.003926 0.001133 0.000094 0.000199 -0.000852 0.002950 0.000910 0.001414 0.003884 0.000204 0.056597 0.025641 0.014133 0.009346 -0.003965 -0.001937 -0.003939 0.006835 -0.002125 0.009644 -0.000355 0.001544 0.000872 -0.011085 0.015110 -0.009545 0.024027 -0.001478 -0.001267 -0.002930 -0.001052 0.002854 0.001802 0.000606 -0.000696 0.015525 0.000098 0.025802 -0.002147 0.000409 -0.000316 -0.000527 -0.001144 -0.003255 0.000549 -0.000381 0.000953 0.001033 0.001255 0.001303 0.000664 0.003420 0.3187 0.0706 0.9452 0.0731 0.9924 -0.0988 0.945 -0.1006 -0.3112 -0.0124 -0.005 0.0174 -1.669 -0.669 2.338 -0.596 -0.239 0.834 -0.557 -0.223 0.78 1 C 13 0.9456 -0.1003 -0.3095 0.0731 0.9924 -0.0985 0.3171 0.0705 0.9458 -0.2843 -0.2825 0.5668 20.573 20.438 -41.012 7.341 7.293 -14.634 6.863 6.818 -13.68 2 O 17 0.0804 0.9916 -0.1011 0.9472 -0.1076 -0.3021 0.3105 0.0715 0.9479 -0.1265 -0.1248 0.2513 -21.655 -21.376 43.031 -7.727 -7.627 15.354 -7.223 -7.13 14.353 3 B 11 -0.5413 0.8325 0.1184 0.7705 0.5474 -0.3266 0.3367 0.0855 0.9377 -0.0622 -0.059 0.1211 -8.34 -7.917 16.257 -2.976 -2.825 5.801 -2.782 -2.641 5.423 4 C 13 0.6547 0.7055 -0.2714 -0.6778 0.7069 0.2022 0.3344 0.0516 0.941 -0.0622 -0.059 0.1212 -8.341 -7.917 16.258 -2.976 -2.825 5.801 -2.782 -2.641 5.423 5 C 13 0.3069 0.0847 0.948 0.7884 -0.5805 -0.2034 0.5331 0.8098 -0.2449 -0.0274 0.0116 0.0158 -3.682 1.561 2.121 -1.314 0.557 0.757 -1.228 0.521 0.708 6 C 13 0.3055 0.0596 0.9503 0.8608 0.4094 -0.3024 -0.407 0.9104 0.0738 -0.0275 0.0117 0.0158 -3.691 1.565 2.126 -1.317 0.558 0.759 -1.231 0.522 0.709 7 C 13 0.3259 0.0402 0.9445 0.9443 -0.0621 -0.3232 0.0457 0.9973 -0.0582 -0.0638 0.028 0.0358 -8.56 3.753 4.807 -3.054 1.339 1.715 -2.855 1.252 1.603 8 C 13 0.8771 0.3619 -0.3158 -0.354 0.9314 0.0844 0.3247 0.0377 0.9451 -0.061 -0.0538 0.1148 -8.186 -7.221 15.407 -2.921 -2.577 5.498 -2.73 -2.409 5.139 9 C 13 0.3204 0.0372 0.9465 0.7592 0.5875 -0.2801 -0.5666 0.8083 0.16 -0.0664 0.0285 0.0379 -8.914 3.825 5.089 -3.181 1.365 1.816 -2.973 1.276 1.697 10 C 13 0.9525 -0.0266 -0.3034 0.013 0.9988 -0.0468 0.3043 0.0406 0.9517 -0.088 -0.0815 0.1695 -3.394 -3.143 6.536 -1.211 -1.121 2.332 -1.132 -1.048 2.18 11 N 14 0.9304 0.0196 -0.3659 0.3647 0.0482 0.9299 -0.0359 0.9986 -0.0377 -0.0034 -0.0031 0.0064 -1.799 -1.632 3.431 -0.642 -0.582 1.224 -0.6 -0.544 1.144 12 H 1 0.8802 0.3534 -0.3168 0.3232 0.0426 0.9454 -0.3476 0.9345 0.0767 -0.0083 -5.0E-4 0.0088 -4.441 -0.26 4.702 -1.585 -0.093 1.678 -1.481 -0.087 1.568 13 H 1 0.7743 0.5471 0.318 -0.1497 -0.3298 0.9321 -0.6149 0.7693 0.1734 -0.0022 -0.0022 0.0044 -1.196 -1.165 2.361 -0.427 -0.416 0.842 -0.399 -0.389 0.788 14 H 1 0.325 0.1025 0.9402 -0.6615 0.7351 0.1485 0.6758 0.6702 -0.3067 -0.0664 0.0285 0.0379 -8.913 3.825 5.088 -3.18 1.365 1.816 -2.973 1.276 1.697 15 C 13 0.8105 -0.5403 -0.226 0.4845 0.8354 -0.2597 0.3291 0.101 0.9389 -0.061 -0.0538 0.1148 -8.184 -7.22 15.404 -2.92 -2.576 5.496 -2.73 -2.408 5.138 16 C 13 0.33 0.0984 0.9388 0.9386 -0.1402 -0.3152 0.1006 0.9852 -0.1386 -0.0638 0.028 0.0358 -8.559 3.753 4.806 -3.054 1.339 1.715 -2.855 1.252 1.603 17 C 13 0.9418 -0.1722 -0.2888 0.1332 0.9797 -0.1498 0.3087 0.1026 0.9456 -0.088 -0.0815 0.1694 -3.393 -3.142 6.534 -1.211 -1.121 2.332 -1.132 -1.048 2.18 18 N 14 0.913 -0.2259 -0.3398 0.3655 0.0825 0.9271 0.1814 0.9706 -0.1579 -0.0034 -0.0031 0.0064 -1.799 -1.632 3.431 -0.642 -0.582 1.224 -0.6 -0.544 1.144 19 H 1 0.691 -0.5827 0.4278 -0.0848 0.5224 0.8485 0.7178 0.6226 -0.3116 -0.0022 -0.0022 0.0044 -1.196 -1.165 2.361 -0.427 -0.416 0.842 -0.399 -0.389 0.787 20 H 1 0.8148 -0.5328 -0.2286 0.3269 0.0965 0.9401 0.4789 0.8407 -0.2528 -0.0083 -5.0E-4 0.0088 -4.44 -0.26 4.701 -1.584 -0.093 1.677 -1.481 -0.087 1.568 21 H 1 0.353 0.067 0.9332 0.0739 0.9923 -0.0992 0.9327 -0.104 -0.3454 -0.017 0.0045 0.0125 -2.276 0.601 1.676 -0.812 0.214 0.598 -0.759 0.2 0.559 22 C 13 0.1705 0.9755 -0.1392 0.9491 -0.2005 -0.2428 0.2647 0.0907 0.96 -0.0115 -0.0075 0.0191 -1.544 -1.013 2.557 -0.551 -0.361 0.912 -0.515 -0.338 0.853 23 C 13 -0.0247 0.9981 -0.0573 0.9646 0.0087 -0.2636 0.2626 0.0618 0.9629 -0.0115 -0.0075 0.019 -1.539 -1.007 2.546 -0.549 -0.359 0.908 -0.513 -0.336 0.849 24 C 13 0.5997 0.7688 -0.222 0.2573 0.0774 0.9632 0.7577 -0.6347 -0.1514 -0.0021 -0.0016 0.0038 -1.142 -0.862 2.004 -0.407 -0.308 0.715 -0.381 -0.288 0.669 25 H 1 -0.4787 0.876 0.0585 0.2572 0.0763 0.9633 0.8395 0.4762 -0.2618 -0.0021 -0.0016 0.0038 -1.139 -0.863 2.002 -0.406 -0.308 0.714 -0.38 -0.288 0.668 26 H 1 -0.3003 0.9537 0.0189 0.9201 0.2948 -0.2579 0.2515 0.0601 0.966 -0.0947 -0.0876 0.1822 -3.65 -3.378 7.029 -1.303 -1.205 2.508 -1.218 -1.127 2.345 27 N 14 0.4441 0.1119 0.889 0.8499 0.2614 -0.4575 -0.2836 0.9587 0.021 -0.0049 -0.0035 0.0084 -2.615 -1.859 4.474 -0.933 -0.663 1.596 -0.872 -0.62 1.492 28 H 1 0.4353 0.8775 -0.2011 0.8637 -0.4701 -0.1818 0.2541 0.0946 0.9626 -0.0946 -0.0876 0.1822 -3.65 -3.378 7.028 -1.303 -1.205 2.508 -1.218 -1.127 2.344 29 N 14 0.4365 0.0011 0.8997 0.7965 -0.4655 -0.3859 0.4184 0.885 -0.2041 -0.0049 -0.0035 0.0084 -2.613 -1.863 4.476 -0.932 -0.665 1.597 -0.872 -0.621 1.493 30 H 1 0.0728 0.9925 -0.0984 0.9401 -0.1013 -0.3256 0.3331 0.0688 0.9404 -0.0022 -0.0018 0.004 -0.084 -0.069 0.153 -0.03 -0.025 0.055 -0.028 -0.023 0.051 31 N 14 0.7426 0.6134 -0.2689 -0.5526 0.788 0.2717 0.3785 -0.0532 0.9241 -0.0031 -0.0026 0.0057 -0.417 -0.344 0.761 -0.149 -0.123 0.272 -0.139 -0.115 0.254 32 C 13 0.1518 0.9778 0.1445 0.7517 -0.0192 -0.6592 0.6418 -0.2087 0.7379 -0.0013 -9.0E-4 0.0022 -0.691 -0.462 1.153 -0.247 -0.165 0.411 -0.231 -0.154 0.384 33 H 1 -0.3779 0.788 0.4861 0.8802 0.4686 -0.0752 0.287 -0.3994 0.8707 -0.0012 -9.0E-4 0.0021 -0.631 -0.478 1.109 -0.225 -0.17 0.396 -0.211 -0.159 0.37 34 H 1 0.7527 0.6464 -0.1248 -0.4508 0.6442 0.6179 0.4798 -0.4089 0.7763 -0.0038 -0.0033 0.0071 -2.05 -1.75 3.799 -0.731 -0.624 1.356 -0.684 -0.584 1.267 35 H 1 0.074 0.9923 -0.0994 0.9767 -0.0922 -0.1935 0.2012 0.0828 0.976 -0.0025 -0.0016 0.0041 -0.334 -0.218 0.552 -0.119 -0.078 0.197 -0.111 -0.073 0.184 36 C 13 -0.0916 0.9887 0.1186 0.9953 0.0945 -0.0197 0.0306 -0.1162 0.9927 -0.0012 -9.0E-4 0.0021 -0.644 -0.472 1.116 -0.23 -0.168 0.398 -0.215 -0.157 0.372 37 H 1 0.2339 0.9214 -0.3105 0.9703 -0.2416 0.0139 0.0621 0.3045 0.9505 -0.0012 -9.0E-4 0.0021 -0.643 -0.473 1.116 -0.229 -0.169 0.398 -0.215 -0.158 0.372 38 H 1 0.0738 0.9923 -0.0998 0.9898 -0.0607 0.1286 -0.1216 0.1083 0.9867 -0.0042 -0.0016 0.0057 -2.215 -0.829 3.044 -0.79 -0.296 1.086 -0.739 -0.277 1.015 39 H 1 -0.6402 0.7568 0.1316 0.6582 0.6288 -0.414 0.3961 0.1784 0.9007 -0.0031 -0.0025 0.0056 -0.412 -0.34 0.752 -0.147 -0.121 0.268 -0.138 -0.113 0.251 40 C 13 -0.4791 -0.6149 0.6264 0.8021 -0.5965 0.0279 0.3565 0.5158 0.779 -0.0012 -9.0E-4 0.0021 -0.629 -0.479 1.108 -0.224 -0.171 0.395 -0.21 -0.16 0.369 41 H 1 -0.0089 0.9419 -0.3357 0.737 -0.2207 -0.6389 0.6759 0.2531 0.6922 -0.0013 -9.0E-4 0.0022 -0.689 -0.463 1.152 -0.246 -0.165 0.411 -0.23 -0.154 0.384 42 H 1 PT115125.200S 2024-12-17T15:58:20.000 -14.41674 -10.37086 -10.36846 -10.36514 -10.36454 -10.33847 -10.33844 -10.31314 -10.31312 -10.31044 -10.31041 -10.30486 -10.30484 -10.30272 -10.30269 -10.29925 -10.29917 -10.29832 -6.80741 -1.16035 -1.11292 -1.03347 -1.03338 -1.01862 -1.00146 -0.90125 -0.89297 -0.88863 -0.86688 -0.84112 -0.78303 -0.78037 -0.75820 -0.75551 -0.74354 -0.72936 -0.71886 -0.69495 -0.68669 -0.66262 -0.63792 -0.61442 -0.60943 -0.59506 -0.57819 -0.57450 -0.56312 -0.56026 -0.55546 -0.54805 -0.54421 -0.54170 -0.54162 -0.54033 -0.51260 -0.50139 -0.49491 -0.48934 -0.48676 -0.47768 -0.47374 -0.46630 -0.46145 -0.45770 -0.43972 -0.43657 -0.43197 -0.43156 -0.42881 -0.41318 -0.38494 -0.36926 -0.36210 -0.34760 -0.34600 -0.34221 -0.32826 -0.32235 -0.27369 -0.21357 -0.00120 0.04474 0.04990 0.05199 0.07902 0.12877 0.13414 0.14296 0.15413 0.15867 0.17050 0.17365 0.18273 0.18887 0.19162 0.19967 0.20053 0.20912 0.21035 0.21610 0.22353 0.22736 0.23053 0.24296 0.24422 0.25314 0.26105 0.26119 0.26529 0.27357 0.28261 0.28287 0.29978 0.31017 0.31943 0.33207 0.33693 0.33720 0.34396 0.34912 0.35631 0.36617 0.37029 0.37636 0.38708 0.39789 0.40453 0.40831 0.42069 0.42077 0.44529 0.46453 0.47304 0.47685 0.48653 0.48688 0.49740 0.50712 0.51112 0.52668 0.52880 0.53170 0.54159 0.54322 0.54732 0.54806 0.55223 0.56170 0.56259 0.57237 0.57920 0.58566 0.59232 0.61902 0.61903 0.63240 0.63311 0.64199 0.65245 0.65669 0.67218 0.67600 0.67998 0.68948 0.69801 0.69867 0.71301 0.71666 0.72163 0.72289 0.72317 0.72889 0.73528 0.73786 0.74066 0.74409 0.74611 0.75135 0.75551 0.75920 0.76701 0.76856 0.76875 0.77275 0.77841 0.78796 0.79294 0.79979 0.80632 0.81110 0.81369 0.82100 0.82238 0.82681 0.83472 0.84298 0.84686 0.85558 0.85573 0.87069 0.88706 0.89708 0.90627 0.91056 0.92429 0.94206 0.95285 0.95844 0.97268 0.97984 0.98581 0.99431 1.01416 1.01700 1.02683 1.03809 1.05187 1.05234 1.08387 1.10117 1.11069 1.11808 1.13513 1.14364 1.14672 1.15979 1.16590 1.17258 1.19347 1.20205 1.22141 1.22550 1.22749 1.23775 1.25305 1.26298 1.27125 1.27412 1.28818 1.29695 1.30385 1.31102 1.32154 1.32316 1.33700 1.34217 1.34952 1.35891 1.36446 1.37051 1.37205 1.38639 1.39213 1.40453 1.41235 1.41878 1.43421 1.44479 1.45878 1.46486 1.48671 1.51304 1.51994 1.57592 1.57781 1.58201 1.58469 1.58699 1.59701 1.60055 1.63988 1.64571 1.65431 1.66488 1.67832 1.70484 1.72334 1.75257 1.75410 1.76207 1.76340 1.78416 1.78576 1.79670 1.79830 1.80831 1.82303 1.82721 1.83019 1.84863 1.85279 1.85641 1.85957 1.86125 1.86217 1.87974 1.88852 1.88927 1.89582 1.90187 1.90584 1.91759 1.92029 1.92277 1.93846 1.94914 1.95344 1.95380 1.95747 1.97661 1.98075 2.00320 2.00485 2.01214 2.01894 2.01939 2.03123 2.03701 2.04370 2.04784 2.06417 2.08320 2.09415 2.09612 2.10591 2.11275 2.11700 2.12185 2.12465 2.13941 2.14182 2.15291 2.18726 2.20453 2.21504 2.22352 2.22934 2.23996 2.26995 2.28775 2.29262 2.29622 2.32332 2.32566 2.33350 2.34654 2.35976 2.36628 2.37081 2.38798 2.39940 2.40318 2.41551 2.44946 2.45255 2.47252 2.47557 2.47863 2.48448 2.50726 2.51235 2.51595 2.53004 2.53239 2.53737 2.54659 2.54791 2.56968 2.57487 2.61791 2.66137 2.67567 2.68227 2.68841 2.69331 2.73868 2.74515 2.74714 2.76079 2.76265 2.78284 2.80190 2.80556 2.81143 2.81362 2.81951 2.82712 2.82964 2.83842 2.86395 2.87087 2.89762 2.90526 2.91477 2.93179 2.94448 2.98336 2.98351 2.99062 3.00272 3.01165 3.01383 3.02893 3.05547 3.07030 3.11761 3.12402 3.15122 3.19115 3.19849 3.21265 3.24342 3.24640 3.25017 3.26708 3.27320 3.27492 3.38866 3.48958 3.49195 3.49222 3.61357 3.67287 3.72514 3.76410 3.76646 -19.22078 -14.51923 -14.51918 -14.44346 -14.44343 -14.41673 -10.37150 -10.36883 -10.36498 -10.36438 -10.33927 -10.33924 -10.31394 -10.31392 -10.31123 -10.31120 -10.30354 -10.30352 -10.30268 -10.30266 -10.29831 -10.29788 -10.29780 -6.80417 -1.15831 -1.10649 -1.03150 -1.03138 -1.01536 -1.00143 -0.89833 -0.89127 -0.88665 -0.86482 -0.84000 -0.78292 -0.78029 -0.75541 -0.75424 -0.74256 -0.72492 -0.71712 -0.69483 -0.68446 -0.66247 -0.63613 -0.61351 -0.60540 -0.59384 -0.57712 -0.56884 -0.56266 -0.55928 -0.55222 -0.54575 -0.54338 -0.54158 -0.54150 -0.53921 -0.50565 -0.49903 -0.49243 -0.48614 -0.48591 -0.47658 -0.47219 -0.46109 -0.46083 -0.45139 -0.43724 -0.43626 -0.43144 -0.43136 -0.41894 -0.41113 -0.37027 -0.36328 -0.35049 -0.34282 -0.33947 -0.33521 -0.32357 -0.31840 -0.27328 -0.02853 0.00881 0.05304 0.05918 0.06571 0.08321 0.12928 0.14205 0.14292 0.15430 0.15884 0.17078 0.18298 0.18751 0.18917 0.19293 0.20066 0.20068 0.20904 0.21014 0.21615 0.22552 0.23110 0.23282 0.24316 0.24425 0.25405 0.26118 0.26212 0.26527 0.27454 0.28289 0.28365 0.29920 0.31051 0.32291 0.33666 0.33794 0.34398 0.34757 0.35055 0.35713 0.36719 0.37063 0.37576 0.38763 0.40131 0.40559 0.40837 0.42075 0.42077 0.44654 0.46512 0.47511 0.47770 0.48650 0.49428 0.50229 0.50777 0.51385 0.52736 0.53002 0.53432 0.54373 0.54455 0.54784 0.54882 0.55260 0.56180 0.56363 0.57297 0.57993 0.58767 0.59243 0.61824 0.61900 0.63133 0.63452 0.64327 0.65419 0.65822 0.67347 0.67746 0.68343 0.69024 0.69839 0.69939 0.71347 0.71708 0.72254 0.72266 0.72430 0.72921 0.73579 0.73819 0.74116 0.74491 0.74648 0.75156 0.75588 0.75994 0.76779 0.76904 0.76949 0.77386 0.77897 0.78891 0.79405 0.80045 0.80670 0.81196 0.81408 0.82162 0.82330 0.82859 0.83546 0.84359 0.84696 0.85607 0.85736 0.87178 0.88795 0.89870 0.90821 0.91165 0.92594 0.94338 0.95259 0.96041 0.97706 0.98050 0.98659 0.99652 1.01561 1.01797 1.02852 1.04000 1.05254 1.05357 1.09232 1.10296 1.11122 1.12310 1.13704 1.15181 1.15865 1.16160 1.16720 1.17555 1.20124 1.20248 1.22230 1.22762 1.22945 1.23893 1.25572 1.26401 1.27280 1.27572 1.29048 1.29776 1.30472 1.31204 1.32286 1.32443 1.33834 1.34265 1.35119 1.36155 1.36584 1.37192 1.37365 1.38744 1.39357 1.40468 1.41405 1.42123 1.44115 1.44639 1.45957 1.46672 1.48927 1.51500 1.52164 1.57696 1.58230 1.58471 1.58662 1.58912 1.60116 1.60152 1.64138 1.64584 1.65700 1.66547 1.68155 1.70891 1.72710 1.75439 1.75455 1.76246 1.76440 1.78484 1.78618 1.79794 1.79903 1.80942 1.82450 1.82739 1.83186 1.85016 1.85535 1.85934 1.86101 1.86201 1.86311 1.88072 1.88975 1.89001 1.89693 1.90227 1.90617 1.91878 1.92049 1.92315 1.93972 1.94916 1.95385 1.95387 1.95826 1.97673 1.98082 2.00431 2.00566 2.01417 2.01953 2.02249 2.03179 2.03857 2.04726 2.05039 2.06517 2.08384 2.09425 2.09711 2.10607 2.11282 2.11823 2.12198 2.12678 2.14122 2.14223 2.15332 2.18861 2.20599 2.21560 2.22436 2.23026 2.24205 2.27027 2.28776 2.29198 2.29644 2.32519 2.32772 2.33530 2.34718 2.36056 2.36771 2.37151 2.38973 2.39951 2.40329 2.41716 2.45214 2.45407 2.47256 2.47628 2.47945 2.48659 2.50950 2.51375 2.51765 2.53074 2.53260 2.53798 2.54818 2.54957 2.57360 2.57608 2.61956 2.66299 2.67883 2.68510 2.68967 2.69620 2.74094 2.74521 2.74900 2.76088 2.76306 2.78338 2.80472 2.80787 2.81154 2.81389 2.82744 2.82876 2.83458 2.83962 2.86485 2.87832 2.90070 2.90848 2.91546 2.93361 2.94668 2.98364 2.98376 2.99198 3.00504 3.01222 3.01440 3.02905 3.05612 3.07065 3.11824 3.12464 3.15348 3.19271 3.19978 3.21362 3.24560 3.24647 3.25708 3.26839 3.27326 3.27511 3.38941 3.49079 3.49329 3.49341 3.61494 3.67384 3.72611 3.76729 3.76765 2.25351776e+00 -2.62279930e-01 -9.72933361e-01 ./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999'] 5.7279 -0.6666 -2.4729 6.2744 -132.3253 -119.0077 -146.1681 -0.1211 -11.7952 -1.8715 0.1751 13.4926 -13.6677 -0.1211 -11.7952 -1.8715 117.6271 -1.0032 -14.4688 -12.9039 -16.7788 -46.2297 -1.3838 -2.5137 -2.0898 4.4867 -3679.6593 -3056.5011 -2089.1542 36.8253 -13.5031 5.6890 33.9235 66.6491 58.8584 -1059.2104 -935.3236 -908.8092 11.6290 -6.0357 9.5863 0 -1032.0358693 0.779758 0. 0.750743 5.253E-9 5.691E-6 0.1301537,10.0314537,-10.1616075,-0.0900203,-8.7694395,-1.3914408 C01 [X(C17H19B1N5O1)] 2.2535178 -0.2622799 -0.9729334 0.000033294 -0.000001247 -0.000001951 -0.000009986 -0.000001527 -0.000000939 -0.000003124 -0.000005195 -0.000009176 -0.000010326 0.000009208 0.000000752 -0.000012314 -0.000006748 0.000000744 0.000002030 -0.000002277 0.000003349 0.000004908 -0.000002182 -0.000009598 -0.000000975 0.000000693 0.000000226 -0.000004728 -0.000001347 0.000002088 -0.000001320 0.000000027 -0.000006733 -0.000002554 0.000002935 0.000010576 -0.000000839 -0.000001410 0.000000207 -0.000002077 -0.000000607 0.000000075 -0.000000497 0.000000272 0.000001107 -0.000002018 -0.000002494 0.000002224 0.000003826 -0.000002222 -0.000000969 0.000000265 0.000003764 0.000001784 -0.000000942 0.000009679 0.000001556 -0.000000039 -0.000000914 -0.000000449 0.000002165 0.000000694 -0.000000722 0.000000695 -0.000000293 0.000000217 0.000007277 -0.000000337 0.000011238 -0.000003173 -0.000000969 -0.000009064 -0.000002770 0.000007418 0.000001952 0.000000811 0.000001162 0.000005693 -0.000001885 0.000001900 -0.000003638 0.000001216 -0.000000558 -0.000001873 0.000001948 0.000002291 0.000003622 -0.000006098 -0.000004901 0.000004382 0.000003501 0.000002005 0.000002506 0.000007948 -0.000004968 0.000009375 -0.000004429 -0.000009248 -0.000004182 0.000000894 0.000000238 0.000002217 -0.000002457 -0.000000153 -0.000001498 0.000007975 0.000008619 -0.000005065 -0.000005818 -0.000002026 0.000000742 0.000001369 0.000000252 0.000002125 -0.000002119 -0.000000651 -0.000000583 -0.000000936 0.000000305 -0.000000103 -0.000005208 0.000019091 -0.000004675 0.000000015 -0.000000565 0.000001111 -0.000000454 0.000000768 0.000000352 0.000006953 -0.000018480 -0.000009001 301.02579999999995 AuxInfo=1/0/N:9,16,8,17,10,15,23,24,5,4,1,6,7,22,3,11,18,29,27,2;32,36,40,31/E:(1,2)(3,4)(5,6)(7,8)(9,10)(12,13)(16,17)(18,19);(1,2,3)/CRV:1.3,2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,16.2,17.2,20.1;/rA:43nC3O1BC3C3C3C3C3C3C3N2HHHC3C3C3N2HHHC3C3C3HHNHNHNCHHHCHHHCHHH/rB:s1;;s1;s1;s3s5;s3s4;s5;s8;s9;s6s10;s8;s9;s10;;s15;s4s16;s7s15;s17;s15;s16;s3;;s23;s23;s24;s22s24;s27;s22s23;s29;;s31;s32;s32;s32;s31;s36;s36;s36;s31;s40;s40;s40;/rC:-2.5872,.2047,.04;-3.7432,.328,.4216;.1966,-.0946,-.9026;-1.9609,-1.1444,-.063;-1.7729,1.4018,-.3161;-.4366,1.2941,-.7739;-.6298,-1.324,-.5134;-2.3439,2.6722,-.1777;-1.5847,3.7896,-.4871;-.2662,3.5972,-.9274;.2955,2.4085,-1.0703;-3.3748,2.7472,.1757;-1.9886,4.7987,-.3915;.3565,4.4653,-1.1727;-.7987,-3.6123,-.2107;-2.1248,-3.5209,.2393;-2.7088,-2.2662,.3129;-.0719,-2.5692,-.5751;-3.7345,-2.1197,.6589;-.3126,-4.5929,-.2721;-2.6699,-4.422,.5244;1.6637,-.2454,-1.3316;3.6629,-1.1253,-1.7846;3.7624,.2302,-1.9194;4.4089,-1.902,-1.9181;4.611,.8495,-2.1914;2.5201,.7463,-1.6387;2.158,1.7105,-1.6;2.3631,-1.3912,-1.4261;1.8662,-2.2665,-1.2047;1.5307,.191,2.9456;1.9476,-1.1007,2.4544;3.0466,-1.175,2.4726;1.5476,-1.8974,3.1009;1.6068,-1.3121,1.417;.0937,.3086,3.0393;-.3111,-.4935,3.6755;-.1781,1.2716,3.4986;-.4173,.2484,2.054;2.1274,1.2843,2.2163;1.86,2.243,2.6877;3.2254,1.1966,2.2355;1.806,1.3361,1.1527; Gaussian 16 GINC-BERON207 GRUFOR coments ES64L-G16RevC.02 UwB97XD def2SVP Freq #P Geom=AllCheck Guess=TCheck SCRF=Check GenChk UwB97XD/def2SVPFreq 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 301.02579999999995 AuxInfo=1/0/N:9,16,8,17,10,15,23,24,5,4,1,6,7,22,3,11,18,29,27,2;32,36,40,31/E:(1,2)(3,4)(5,6)(7,8)(9,10)(12,13)(16,17)(18,19);(1,2,3)/CRV:1.3,2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,16.2,17.2,20.1;/rA:43nC3O1BC3C3C3C3C3C3C3N2HHHC3C3C3N2HHHC3C3C3HHNHNHNCHHHCHHHCHHH/rB:s1;;s1;s1;s3s5;s3s4;s5;s8;s9;s6s10;s8;s9;s10;;s15;s4s16;s7s15;s17;s15;s16;s3;;s23;s23;s24;s22s24;s27;s22s23;s29;;s31;s32;s32;s32;s31;s36;s36;s36;s31;s40;s40;s40;/rC:-2.5872,.2047,.04;-3.7432,.328,.4216;.1966,-.0946,-.9026;-1.9609,-1.1444,-.063;-1.7729,1.4018,-.3161;-.4366,1.2941,-.7739;-.6298,-1.324,-.5134;-2.3439,2.6722,-.1777;-1.5847,3.7896,-.4871;-.2662,3.5972,-.9274;.2955,2.4085,-1.0703;-3.3748,2.7472,.1757;-1.9886,4.7987,-.3915;.3565,4.4653,-1.1727;-.7987,-3.6123,-.2107;-2.1248,-3.5209,.2393;-2.7088,-2.2662,.3129;-.0719,-2.5692,-.5751;-3.7345,-2.1197,.6589;-.3126,-4.5929,-.2721;-2.6699,-4.422,.5244;1.6637,-.2454,-1.3316;3.6629,-1.1253,-1.7846;3.7624,.2302,-1.9194;4.4089,-1.902,-1.9181;4.611,.8495,-2.1914;2.5201,.7463,-1.6387;2.158,1.7105,-1.6;2.3631,-1.3912,-1.4261;1.8662,-2.2665,-1.2047;1.5307,.191,2.9456;1.9476,-1.1007,2.4544;3.0466,-1.175,2.4726;1.5476,-1.8974,3.1009;1.6068,-1.3121,1.417;.0937,.3086,3.0393;-.3111,-.4935,3.6755;-.1781,1.2716,3.4986;-.4173,.2484,2.054;2.1274,1.2843,2.2163;1.86,2.243,2.6877;3.2254,1.1966,2.2355;1.806,1.3361,1.1527; coments Redundant internal coordinates found in file. (old form). 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 12 16 11 12 12 12 12 12 12 12 14 1 1 1 12 12 12 14 1 1 1 12 12 12 1 1 14 1 14 1 14 12 1 1 1 12 1 1 1 12 1 1 1 12.0000000 15.9949146 11.0093053 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 14.0030740 1.0078250 1.0078250 1.0078250 12.0000000 12.0000000 12.0000000 14.0030740 1.0078250 1.0078250 1.0078250 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 14.0030740 1.0078250 14.0030740 1.0078250 14.0030740 12.0000000 1.0078250 1.0078250 1.0078250 12.0000000 1.0078250 1.0078250 1.0078250 12.0000000 1.0078250 1.0078250 1.0078250 0 0 3 0 0 0 0 0 0 0 2 1 1 1 0 0 0 2 1 1 1 0 0 0 1 1 2 1 2 1 2 0 1 1 1 0 1 1 1 0 1 1 1 3.6000000 5.6000000 2.7500000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 4.5500000 1.0000000 1.0000000 1.0000000 3.6000000 3.6000000 3.6000000 4.5500000 1.0000000 1.0000000 1.0000000 3.6000000 3.6000000 3.6000000 1.0000000 1.0000000 4.5500000 1.0000000 4.5500000 1.0000000 4.5500000 3.6000000 1.0000000 1.0000000 1.0000000 3.6000000 1.0000000 1.0000000 1.0000000 3.6000000 1.0000000 1.0000000 1.0000000 (Enter /NFS_R1/Userdata/grufor/SOFTWARE/g16/l101.exe) Structure from the checkpoint file: "18_a_TMA_2.chk" Berny optimization. R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45 R46 R47 R48 R49 R50 1 1 1 3 3 3 3 4 4 5 5 6 7 7 8 8 9 9 10 10 11 15 15 15 16 16 17 22 22 22 23 23 23 24 24 27 29 29 31 31 31 32 32 32 36 36 36 40 40 40 2 4 5 6 7 22 39 7 17 6 8 11 18 39 9 12 10 13 11 14 43 16 18 20 17 21 19 27 29 35 24 25 29 26 27 28 30 35 32 36 40 33 34 35 37 38 39 41 42 43 1.2236 1.4909 1.491 1.5316 1.5316 1.536 3.0391 1.4167 1.3997 1.4167 1.3997 1.3659 1.3659 3.0181 1.3859 1.0923 1.4033 1.0911 1.3225 1.0962 2.8937 1.4034 1.3225 1.0962 1.3859 1.0911 1.0923 1.3458 1.3458 2.9489 1.3658 1.0852 1.3743 1.0852 1.3742 1.0307 1.0305 2.943 1.4434 1.4449 1.4433 1.1017 1.1012 1.1123 1.1009 1.1009 1.1115 1.1012 1.1017 1.1123 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 A86 A87 2 2 4 6 6 6 7 22 1 1 7 1 1 6 3 3 5 3 3 4 4 18 5 5 9 8 8 10 9 9 11 6 6 10 16 16 18 15 15 17 4 4 16 7 3 3 3 27 27 24 24 25 23 23 26 22 22 24 22 22 23 23 30 32 32 36 31 31 31 33 33 34 22 31 31 31 37 37 38 3 31 31 31 41 41 42 11 1 1 1 3 3 3 3 3 4 4 4 5 5 5 6 6 6 7 7 7 7 7 8 8 8 9 9 9 10 10 10 11 11 11 15 15 15 16 16 16 17 17 17 18 22 22 22 22 22 23 23 23 24 24 24 27 27 27 29 29 29 29 29 31 31 31 32 32 32 32 32 32 35 36 36 36 36 36 36 39 40 40 40 40 40 40 43 4 5 5 7 22 39 22 39 7 17 17 6 8 8 5 11 11 4 18 18 39 39 9 12 12 10 13 13 11 14 14 10 43 43 18 20 20 17 21 21 16 19 19 15 27 29 35 29 35 25 29 29 26 27 27 24 28 28 23 30 30 35 35 36 40 40 33 34 35 34 35 35 32 37 38 39 38 39 39 36 41 42 43 42 43 43 40 120.6327 120.6366 118.7271 118.9045 120.4872 74.4802 120.5011 118.409 122.0963 118.8331 119.0662 122.0913 118.8381 119.0661 119.0837 119.9912 120.9089 119.0784 119.9947 120.9111 74.3172 118.9905 119.0926 118.6404 122.2665 118.3085 121.5582 120.1329 123.794 119.6945 116.5115 118.8284 79.0895 118.1535 123.7951 119.6918 116.513 118.3101 120.1324 121.5571 119.0901 118.6359 122.2735 118.8259 126.8145 126.8408 75.9196 106.301 119.4392 130.3982 106.6597 122.9419 130.3942 106.6639 122.9418 110.1882 117.2083 132.5803 110.1858 117.2264 132.5646 119.3299 72.0222 112.4724 112.7391 112.4719 110.0536 110.0447 113.5138 107.6886 107.9562 107.38 142.6268 110.1131 110.1095 113.2823 107.7875 107.679 107.6795 140.8623 110.0463 110.054 113.5152 107.6884 107.3758 107.9569 154.5094 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically A88 A89 A90 A91 29 7 29 7 35 39 35 39 32 36 32 36 1 13 1 13 -1 -1 -2 -2 206.6583 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically 211.2198 202.4901 197.5448 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 D137 D138 D139 D140 D141 D142 D143 2 2 5 5 2 2 4 4 7 7 22 22 39 39 6 6 22 22 6 6 6 7 7 7 39 39 39 6 22 1 1 1 17 17 17 1 1 7 7 1 1 8 8 1 1 6 6 3 3 5 5 3 4 39 4 4 4 18 18 18 5 5 12 12 8 8 13 13 9 9 14 14 6 10 18 18 20 20 16 20 15 15 21 21 3 3 29 29 35 35 3 3 27 27 3 27 25 25 29 29 24 24 24 25 25 25 23 23 26 26 23 23 23 30 30 30 36 36 36 40 40 40 32 32 32 40 40 40 32 32 32 36 36 36 31 33 34 31 37 38 31 41 42 1 1 1 1 1 1 1 1 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 4 4 4 4 4 4 4 4 4 4 5 5 5 5 5 5 5 5 6 6 6 6 7 7 7 7 7 7 7 7 7 8 8 8 8 9 9 9 9 10 10 10 10 11 11 15 15 15 15 15 15 16 16 16 16 22 22 22 22 22 22 22 22 22 22 22 22 23 23 23 23 23 23 23 23 23 23 24 24 24 24 29 29 29 29 29 29 31 31 31 31 31 31 31 31 31 31 31 31 31 31 31 31 31 31 32 32 32 36 36 36 40 40 40 4 4 4 4 5 5 5 5 6 6 6 6 6 6 7 7 7 7 22 22 22 22 22 22 22 22 22 39 39 7 7 7 7 7 7 17 17 17 17 6 6 6 6 8 8 8 8 11 11 11 11 18 18 18 36 36 36 36 36 36 9 9 9 9 10 10 10 10 11 11 11 11 43 43 16 16 16 16 18 18 17 17 17 17 27 27 27 27 27 27 29 29 29 29 35 35 24 24 24 24 29 29 29 29 29 29 27 27 27 27 32 32 32 32 32 32 32 32 32 32 32 32 36 36 36 36 36 36 40 40 40 40 40 40 35 35 35 39 39 39 43 43 43 7 17 7 17 6 8 6 8 5 11 5 11 5 11 4 18 4 18 27 29 35 27 29 35 27 29 35 36 36 3 18 39 3 18 39 16 19 16 19 3 11 3 11 9 12 9 12 10 43 10 43 15 15 15 31 37 38 31 37 38 10 13 10 13 11 14 11 14 6 43 6 43 40 40 17 21 17 21 7 7 4 19 4 19 24 28 24 28 24 28 23 30 23 30 32 32 26 27 26 27 22 30 35 22 30 35 22 28 22 28 31 33 34 31 33 34 33 34 35 33 34 35 37 38 39 37 38 39 41 42 43 41 42 43 22 22 22 3 3 3 11 11 11 179.3658 -1.4049 -1.3166 177.9127 -179.3553 1.4253 1.3271 -177.8923 -0.8339 177.7187 -177.0881 1.4645 -62.9151 115.6376 0.8438 -177.7265 177.0975 -1.4728 -0.5366 176.7259 115.9003 -176.7307 0.5318 -60.2938 -88.5561 88.7064 27.8808 -116.7746 -0.1316 0.2373 178.7941 64.0456 -178.9903 -0.4335 -115.182 -178.9926 0.7587 0.2605 -179.9883 -0.2573 -178.7962 178.9604 0.4214 178.9872 -0.7597 -0.2562 179.997 -178.7614 -62.5041 -0.2356 116.0217 178.7899 0.2462 88.6171 176.2801 65.0027 -59.6641 56.7207 -54.5567 -179.2235 -0.0722 -179.8471 179.6651 -0.1098 0.2728 -179.643 -179.949 0.1352 -0.1156 -92.9532 179.8026 86.965 -100.9383 16.0498 -0.2788 179.9389 179.6383 -0.1439 0.1141 -179.8055 0.0765 -179.6653 179.8554 0.1136 177.3531 -1.1149 -0.3645 -178.8325 83.1387 -95.3293 -177.3519 1.1181 0.365 178.835 -110.5662 14.0328 -0.0154 179.8399 -179.8546 0.0007 -0.2289 -178.3816 -86.3566 179.917 1.7643 93.7893 0.2278 178.3773 -179.9036 -1.7541 92.6437 -17.0276 -124.7955 -136.041 114.2877 6.5198 -175.6274 -57.1057 63.2595 55.9201 174.4418 -65.193 56.365 175.0851 -64.2759 -175.0428 -56.3227 64.3163 -174.4216 -55.8988 65.2165 57.1256 175.6484 -63.2363 55.1538 -67.1291 177.0147 0.0136 -121.9965 122.0194 103.6226 -18.2382 -134.0925 calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically|calculate D2E/DX2 analytically Berny optimization. local minimum Step number 1 out of a maximum of 2 All quantities printed in internal units (Hartrees-Bohrs-Radians) Second derivative matrix not updated -- analytic derivatives used. 0.00026 0.00041 0.00043 0.00093 0.00138 0.00169 0.00226 0.00356 0.00390 0.00500 0.00565 0.00720 0.00783 0.00863 0.01023 0.01070 0.01177 0.01325 0.01519 0.01586 0.01678 0.01704 0.01845 0.01939 0.01977 0.02033 0.02134 0.02341 0.02518 0.02678 0.02721 0.02825 0.02862 0.03054 0.03141 0.03158 0.03783 0.03923 0.04118 0.04170 0.04218 0.04363 0.04789 0.04865 0.05780 0.06248 0.06297 0.06482 0.06933 0.07351 0.08336 0.08730 0.09827 0.10014 0.10429 0.10518 0.10652 0.10665 0.11013 0.11525 0.11625 0.12541 0.13092 0.13302 0.13541 0.14043 0.14672 0.14969 0.17102 0.18151 0.18902 0.19415 0.20401 0.20876 0.21020 0.21354 0.21978 0.22414 0.23623 0.26183 0.26467 0.27197 0.27266 0.28933 0.29697 0.31082 0.32025 0.32433 0.33153 0.33568 0.33713 0.33936 0.34115 0.34234 0.34689 0.35340 0.35456 0.35718 0.36137 0.36267 0.36615 0.36752 0.36801 0.37504 0.38318 0.38559 0.38784 0.38959 0.40821 0.41609 0.42814 0.43615 0.44167 0.44721 0.45042 0.45952 0.48159 0.50260 0.51105 0.57226 0.57345 0.57794 0.82169 Angle between quadratic step and forces= 73.89 degrees. 1 2 3 0.00141329 0.00000144 0.00000000 0.00000097 0.00000043 0.00000043 R1 R2 R3 R4 R5 R6 R7 R8 R9 R10 R11 R12 R13 R14 R15 R16 R17 R18 R19 R20 R21 R22 R23 R24 R25 R26 R27 R28 R29 R30 R31 R32 R33 R34 R35 R36 R37 R38 R39 R40 R41 R42 R43 R44 R45 R46 R47 R48 R49 R50 A1 A2 A3 A4 A5 A6 A7 A8 A9 A10 A11 A12 A13 A14 A15 A16 A17 A18 A19 A20 A21 A22 A23 A24 A25 A26 A27 A28 A29 A30 A31 A32 A33 A34 A35 A36 A37 A38 A39 A40 A41 A42 A43 A44 A45 A46 A47 A48 A49 A50 A51 A52 A53 A54 A55 A56 A57 A58 A59 A60 A61 A62 A63 A64 A65 A66 A67 A68 A69 A70 A71 A72 A73 A74 A75 A76 A77 A78 A79 A80 A81 A82 A83 A84 A85 A86 A87 A88 A89 A90 A91 D1 D2 D3 D4 D5 D6 D7 D8 D9 D10 D11 D12 D13 D14 D15 D16 D17 D18 D19 D20 D21 D22 D23 D24 D25 D26 D27 D28 D29 D30 D31 D32 D33 D34 D35 D36 D37 D38 D39 D40 D41 D42 D43 D44 D45 D46 D47 D48 D49 D50 D51 D52 D53 D54 D55 D56 D57 D58 D59 D60 D61 D62 D63 D64 D65 D66 D67 D68 D69 D70 D71 D72 D73 D74 D75 D76 D77 D78 D79 D80 D81 D82 D83 D84 D85 D86 D87 D88 D89 D90 D91 D92 D93 D94 D95 D96 D97 D98 D99 D100 D101 D102 D103 D104 D105 D106 D107 D108 D109 D110 D111 D112 D113 D114 D115 D116 D117 D118 D119 D120 D121 D122 D123 D124 D125 D126 D127 D128 D129 D130 D131 D132 D133 D134 D135 D136 D137 D138 D139 D140 D141 D142 D143 2.31223 2.81748 2.81749 2.89432 2.89432 2.90260 5.74302 2.67712 2.64499 2.67709 2.64497 2.58122 2.58121 5.70343 2.61892 2.06417 2.65190 2.06192 2.49923 2.07150 5.46831 2.65195 2.49919 2.07151 2.61890 2.06191 2.06420 2.54313 2.54318 5.57261 2.58093 2.05076 2.59704 2.05078 2.59688 1.94767 1.94745 5.56154 2.72755 2.73045 2.72750 2.08190 2.08103 2.10187 2.08040 2.08040 2.10047 2.08104 2.08190 2.10188 2.10544 2.10551 2.07218 2.07528 2.10290 1.29993 2.10314 2.06663 2.13098 2.07403 2.07810 2.13089 2.07412 2.07810 2.07840 2.09424 2.11026 2.07831 2.09430 2.11030 1.29708 2.07678 2.07856 2.07067 2.13395 2.06487 2.12159 2.09671 2.16061 2.08906 2.03351 2.07395 1.38037 2.06217 2.16063 2.08902 2.03354 2.06490 2.09671 2.12157 2.07851 2.07059 2.13408 2.07390 2.21333 2.21379 1.32505 1.85530 2.08461 2.27588 1.86156 2.14574 2.27581 1.86164 2.14574 1.92315 2.04567 2.31396 1.92311 2.04599 2.31369 2.08270 1.25702 1.96301 1.96767 1.96300 1.92080 1.92064 1.98119 1.87952 1.88419 1.87413 2.48931 1.92184 1.92177 1.97715 1.88125 1.87935 1.87936 2.45851 1.92067 1.92080 1.98121 1.87952 1.87406 1.88420 2.69670 3.60687 3.68648 3.53412 3.44781 3.13052 -0.02452 -0.02298 3.10516 -3.13034 0.02488 0.02316 -3.10481 -0.01455 3.10178 -3.09077 0.02556 -1.09808 2.01826 0.01473 -3.10191 3.09093 -0.02571 -0.00937 3.08445 2.02284 -3.08453 0.00928 -1.05233 -1.54560 1.54822 0.48661 -2.03810 -0.00230 0.00414 3.12055 1.11781 -3.12397 -0.00757 -2.01030 -3.12401 0.01324 0.00455 -3.14139 -0.00449 -3.12058 3.12345 0.00736 3.12392 -0.01326 -0.00447 3.14154 -3.11997 -1.09090 -0.00411 2.02496 3.12047 0.00430 1.54666 3.07667 1.13451 -1.04133 0.98996 -0.95219 -3.12804 -0.00126 -3.13892 3.13575 -0.00192 0.00476 -3.13536 -3.14070 0.00236 -0.00202 -1.62234 3.13815 1.51783 -1.76171 0.28012 -0.00487 3.14053 3.13528 -0.00251 0.00199 -3.13820 0.00134 -3.13575 3.13907 0.00198 3.09540 -0.01946 -0.00636 -3.12122 1.45104 -1.66381 -3.09537 0.01951 0.00637 3.12126 -1.92974 0.24492 -0.00027 3.13880 -3.13905 0.00001 -0.00400 -3.11335 -1.50721 3.14014 0.03079 1.63693 0.00398 3.11327 -3.13991 -0.03061 1.61694 -0.29719 -2.17809 -2.37436 1.99470 0.11379 -3.06528 -0.99668 1.10409 0.97599 3.04458 -1.13783 0.98376 3.05581 -1.12183 -3.05507 -0.98302 1.12253 -3.04423 -0.97562 1.13824 0.99703 3.06564 -1.10368 0.96262 -1.17162 3.08949 0.00024 -2.12924 2.12964 1.80856 -0.31832 -2.34036 0.00001 -0.00002 -0.00002 0.00000 -0.00001 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00001 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00001 0.00000 -0.00000 -0.00001 0.00000 0.00001 0.00001 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00001 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00001 -0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00001 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00001 -0.00000 0.00001 -0.00000 0.00000 -0.00000 0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 -0.00000 -0.00000 0.00000 -0.00000 -0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00000 0.00002 -0.00006 -0.00006 0.00002 -0.00002 -0.00002 -0.00322 0.00001 -0.00001 0.00001 0.00000 -0.00001 -0.00002 -0.00372 -0.00001 -0.00000 0.00001 0.00000 -0.00000 0.00000 0.00621 -0.00001 0.00001 -0.00000 0.00001 -0.00000 0.00000 0.00000 -0.00001 0.00157 0.00001 -0.00000 0.00000 -0.00000 -0.00001 -0.00000 -0.00000 -0.00164 0.00003 0.00005 0.00002 0.00001 -0.00002 0.00000 -0.00000 -0.00000 -0.00002 -0.00002 0.00001 0.00002 -0.00002 -0.00001 0.00004 -0.00000 0.00002 0.00067 -0.00002 -0.00042 -0.00001 0.00000 0.00000 -0.00001 -0.00000 0.00001 -0.00001 0.00002 -0.00001 -0.00001 0.00001 -0.00000 0.00052 -0.00073 -0.00001 -0.00001 0.00001 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00055 0.00211 -0.00000 0.00001 -0.00001 0.00000 0.00001 -0.00001 -0.00000 0.00000 0.00000 0.00001 -0.00001 0.00000 0.00072 0.00001 0.00057 0.00001 0.00000 -0.00001 0.00001 -0.00000 -0.00001 -0.00000 0.00002 -0.00002 -0.00001 0.00001 0.00000 0.00001 -0.00093 0.00001 -0.00025 -0.00003 -0.00001 0.00002 -0.00007 0.00003 -0.00002 0.00005 0.00075 -0.00002 -0.00001 0.00002 -0.00001 0.00004 -0.00001 0.00093 0.00006 0.00000 -0.00016 0.00004 0.00012 -0.00005 -0.00324 -0.00187 -0.00021 -0.00044 -0.00122 -0.00020 -0.00026 -0.00015 -0.00022 0.00003 -0.00002 -0.00002 -0.00006 -0.00022 -0.00006 -0.00018 -0.00002 -0.00032 -0.00016 0.00006 0.00022 0.00002 0.00017 -0.00029 -0.00011 0.00093 -0.00024 -0.00007 0.00098 -0.00091 -0.00073 0.00032 0.00023 0.00057 0.00012 -0.00004 0.00054 0.00019 0.00003 0.00060 0.00007 0.00006 0.00001 -0.00001 0.00020 0.00004 0.00024 0.00008 0.00004 0.00001 -0.00000 -0.00003 -0.00028 0.00185 -0.00011 0.00201 -0.00021 -0.00004 0.00020 -0.00103 -0.00114 -0.00093 -0.00112 -0.00123 -0.00102 -0.00005 -0.00005 -0.00001 -0.00002 0.00001 0.00004 0.00002 0.00005 0.00007 -0.00045 0.00004 -0.00048 0.00076 0.00061 0.00002 0.00002 0.00001 0.00001 0.00002 0.00003 -0.00003 -0.00002 -0.00004 -0.00002 0.00016 0.00033 0.00001 0.00019 -0.00128 -0.00111 -0.00017 -0.00010 -0.00003 0.00004 0.00295 0.00336 0.00024 0.00016 0.00006 -0.00002 0.00003 -0.00006 -0.00143 -0.00013 -0.00022 -0.00159 0.00000 -0.00020 -0.00007 -0.00027 -0.00053 -0.00120 -0.00239 -0.00083 -0.00151 -0.00269 0.00116 0.00120 0.00123 0.00140 0.00144 0.00148 0.00021 0.00017 0.00016 -0.00015 -0.00019 -0.00020 -0.00100 -0.00091 -0.00109 -0.00078 -0.00069 -0.00086 -0.00428 -0.00421 -0.00426 -0.00154 -0.00156 -0.00155 -0.00095 -0.00100 -0.00108 0.00002 -0.00006 -0.00006 0.00002 -0.00002 -0.00002 -0.00322 0.00001 -0.00001 0.00001 0.00000 -0.00001 -0.00002 -0.00372 -0.00001 -0.00000 0.00001 0.00000 -0.00000 0.00000 0.00622 -0.00001 0.00001 -0.00000 0.00001 -0.00000 0.00000 0.00000 -0.00001 0.00156 0.00001 -0.00000 0.00000 -0.00000 -0.00001 -0.00000 -0.00000 -0.00164 0.00003 0.00005 0.00003 0.00001 -0.00002 -0.00000 -0.00000 -0.00000 -0.00002 -0.00002 0.00001 0.00002 -0.00002 -0.00001 0.00003 -0.00000 0.00002 0.00067 -0.00001 -0.00042 -0.00001 0.00000 0.00000 -0.00001 -0.00000 0.00001 -0.00001 0.00002 -0.00001 -0.00001 0.00001 -0.00000 0.00052 -0.00073 -0.00001 -0.00001 0.00001 -0.00000 -0.00000 0.00000 0.00000 -0.00000 -0.00000 0.00000 -0.00055 0.00211 -0.00000 0.00001 -0.00001 0.00000 0.00001 -0.00001 -0.00000 0.00000 0.00000 0.00001 -0.00001 0.00000 0.00071 0.00001 0.00057 0.00001 0.00001 -0.00001 0.00001 -0.00000 -0.00001 -0.00000 0.00002 -0.00002 -0.00001 0.00001 0.00000 0.00001 -0.00093 0.00001 -0.00025 -0.00003 -0.00000 0.00002 -0.00007 0.00003 -0.00002 0.00005 0.00075 -0.00002 -0.00001 0.00002 -0.00001 0.00004 -0.00001 0.00093 0.00006 0.00000 -0.00016 0.00004 0.00012 -0.00005 -0.00324 -0.00186 -0.00020 -0.00044 -0.00122 -0.00020 -0.00026 -0.00015 -0.00022 0.00003 -0.00002 -0.00002 -0.00006 -0.00022 -0.00006 -0.00018 -0.00002 -0.00032 -0.00016 0.00006 0.00022 0.00002 0.00017 -0.00029 -0.00011 0.00093 -0.00024 -0.00007 0.00098 -0.00090 -0.00073 0.00032 0.00023 0.00057 0.00012 -0.00004 0.00053 0.00019 0.00003 0.00060 0.00007 0.00006 0.00001 -0.00001 0.00020 0.00004 0.00024 0.00008 0.00004 0.00001 -0.00000 -0.00003 -0.00028 0.00185 -0.00012 0.00201 -0.00021 -0.00004 0.00020 -0.00103 -0.00114 -0.00093 -0.00112 -0.00123 -0.00102 -0.00005 -0.00005 -0.00001 -0.00002 0.00001 0.00004 0.00002 0.00005 0.00007 -0.00045 0.00004 -0.00048 0.00076 0.00061 0.00002 0.00002 0.00001 0.00001 0.00002 0.00003 -0.00003 -0.00002 -0.00004 -0.00002 0.00016 0.00033 0.00001 0.00018 -0.00128 -0.00111 -0.00017 -0.00010 -0.00003 0.00004 0.00295 0.00336 0.00024 0.00016 0.00006 -0.00002 0.00003 -0.00006 -0.00143 -0.00013 -0.00022 -0.00159 0.00000 -0.00020 -0.00007 -0.00027 -0.00053 -0.00120 -0.00238 -0.00084 -0.00151 -0.00269 0.00116 0.00120 0.00123 0.00140 0.00144 0.00148 0.00021 0.00017 0.00016 -0.00015 -0.00019 -0.00020 -0.00100 -0.00091 -0.00109 -0.00078 -0.00069 -0.00086 -0.00428 -0.00421 -0.00426 -0.00154 -0.00156 -0.00155 -0.00095 -0.00100 -0.00108 2.31225 2.81742 2.81743 2.89435 2.89430 2.90258 5.73980 2.67713 2.64499 2.67709 2.64497 2.58122 2.58118 5.69971 2.61891 2.06417 2.65191 2.06192 2.49923 2.07150 5.47452 2.65194 2.49920 2.07151 2.61890 2.06191 2.06420 2.54314 2.54318 5.57417 2.58093 2.05076 2.59704 2.05078 2.59688 1.94767 1.94745 5.55991 2.72757 2.73050 2.72752 2.08191 2.08101 2.10187 2.08039 2.08040 2.10045 2.08102 2.08191 2.10189 2.10542 2.10549 2.07221 2.07527 2.10291 1.30059 2.10313 2.06620 2.13098 2.07403 2.07810 2.13088 2.07412 2.07811 2.07839 2.09427 2.11025 2.07830 2.09431 2.11029 1.29760 2.07605 2.07855 2.07066 2.13397 2.06487 2.12159 2.09672 2.16062 2.08906 2.03351 2.07395 1.37982 2.06428 2.16063 2.08903 2.03353 2.06490 2.09671 2.12156 2.07851 2.07059 2.13408 2.07391 2.21332 2.21379 1.32576 1.85531 2.08518 2.27589 1.86157 2.14573 2.27582 1.86163 2.14573 1.92314 2.04569 2.31394 1.92310 2.04600 2.31369 2.08271 1.25609 1.96303 1.96742 1.96298 1.92079 1.92066 1.98112 1.87955 1.88417 1.87419 2.49005 1.92182 1.92176 1.97717 1.88123 1.87939 1.87935 2.45944 1.92073 1.92081 1.98105 1.87956 1.87418 1.88415 2.69346 3.60500 3.68628 3.53368 3.44658 3.13032 -0.02478 -0.02313 3.10495 -3.13031 0.02486 0.02314 -3.10487 -0.01478 3.10171 -3.09095 0.02554 -1.09840 2.01809 0.01479 -3.10170 3.09095 -0.02553 -0.00966 3.08433 2.02377 -3.08478 0.00921 -1.05135 -1.54650 1.54749 0.48693 -2.03787 -0.00172 0.00427 3.12051 1.11834 -3.12378 -0.00754 -2.00970 -3.12394 0.01330 0.00455 -3.14139 -0.00429 -3.12054 3.12369 0.00744 3.12395 -0.01325 -0.00447 3.14151 -3.12025 -1.08905 -0.00423 2.02697 3.12027 0.00425 1.54686 3.07564 1.13337 -1.04226 0.98885 -0.95343 -3.12906 -0.00131 -3.13897 3.13573 -0.00193 0.00478 -3.13532 -3.14069 0.00241 -0.00195 -1.62279 3.13819 1.51735 -1.76094 0.28073 -0.00485 3.14055 3.13529 -0.00250 0.00201 -3.13817 0.00131 -3.13577 3.13903 0.00196 3.09556 -0.01913 -0.00635 -3.12103 1.44976 -1.66492 -3.09555 0.01941 0.00634 3.12130 -1.92679 0.24828 -0.00003 3.13896 -3.13899 -0.00001 -0.00397 -3.11340 -1.50864 3.14001 0.03057 1.63534 0.00398 3.11307 -3.13998 -0.03089 1.61641 -0.29839 -2.18048 -2.37520 1.99319 0.11110 -3.06412 -0.99548 1.10532 0.97739 3.04603 -1.13635 0.98397 3.05598 -1.12167 -3.05522 -0.98320 1.12233 -3.04523 -0.97653 1.13716 0.99625 3.06495 -1.10455 0.95834 -1.17583 3.08523 -0.00131 -2.13080 2.12809 1.80761 -0.31932 -2.34144 |Maximum Force|RMS Force|Maximum Displacement|RMS Displacement| 0.000017 0.000003 0.007050 0.001414 0.000450 0.000300 0.001800 0.001200 YES YES NO NO -9.744141e-08 def2SVP (5D, 7F) 0.10000e-02 0.10000e-05 F 43 43 43 1.00e+00 60 F IExCor= 4639 DFT=T Ex+Corr=wB97XD ExCW=0 ScaHFX= 1.000000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 IRadAn= 5 IRanWt= -1 IRanGd= 0 ICorTp=0 IEmpDi=121 Grimme-D2 -0.0370026415 0.000000 1.223580 0.000000 2.954214 4.177768 0.000000 1.490944 2.362019 2.542011 0.000000 1.490951 2.362070 2.542071 2.565676 0.000000 2.544424 3.646373 1.531611 2.962264 1.416653 0.000000 2.544494 3.646396 1.531606 1.416669 2.962375 2.638060 0.000000 2.488990 2.795102 3.825530 3.837482 1.399657 2.427455 4.361229 0.000000 3.759522 4.179418 4.293286 4.966433 2.401245 2.761876 5.202016 1.385872 0.000000 4.222755 4.959539 3.720749 5.108999 2.731929 2.314513 4.951922 2.394684 1.403325 0.000000 3.794645 4.781793 2.510594 4.327701 2.420871 1.365923 3.885545 2.798761 2.404787 1.322535 0.000000 2.665132 2.459461 4.689656 4.147342 2.148904 3.412632 4.958234 1.092312 2.174880 3.406224 3.890808 0.000000 4.652878 4.871084 5.383319 5.952231 3.404539 3.851902 6.272813 2.166563 1.091120 2.167303 3.375068 2.540073 0.000000 5.318727 6.038805 4.570712 6.170171 3.827958 3.293179 5.909629 3.390818 2.166802 1.096189 2.060339 4.323481 2.494115 0.000000 4.222737 4.959423 3.720736 2.731917 5.109031 4.951881 2.314462 6.471812 7.448665 7.264609 6.179495 6.872355 8.496708 8.216375 0.000000 3.759454 4.179228 4.293252 2.401217 4.966412 5.201928 2.761840 6.210960 7.366266 7.448637 6.536802 6.391806 8.344558 8.481153 1.403350 0.000000 2.488932 2.794922 3.825508 1.399671 3.837461 4.361138 2.427481 4.976127 6.210972 6.471790 5.726406 5.059324 7.136387 7.544326 2.394716 1.385861 0.000000 3.794702 4.781781 2.510629 2.420905 4.327807 3.885570 1.365917 5.726488 6.536883 6.179542 5.015738 6.303733 7.615358 7.072903 1.322516 2.404807 2.798827 0.000000 2.664963 2.459127 4.689581 2.148880 4.147197 4.958049 3.412641 5.059205 6.391704 6.872228 6.303557 4.904013 7.212173 7.965740 3.406310 2.174955 1.092328 3.890888 0.000000 5.318717 6.038679 4.570756 3.827953 6.170232 5.909642 3.293156 7.544369 8.481212 8.216422 7.072916 7.965875 9.540746 9.127478 1.096196 2.166801 3.390829 2.060346 4.323555 0.000000 4.652795 4.870862 5.383281 3.404508 5.952197 6.272719 3.851859 7.136367 8.344553 8.496678 7.615277 7.212267 9.291149 9.540690 2.167317 1.091114 2.166537 3.375071 2.540163 2.494089 0.000000 4.489315 5.712874 1.535988 3.944056 3.943965 2.663116 2.663296 5.089668 5.248438 4.318929 2.997137 6.050910 6.298029 4.891285 4.319305 5.248746 5.089885 2.997518 6.051052 4.891778 6.298357 0.000000 6.645421 7.863165 3.722322 5.881465 6.171785 4.866287 4.481386 7.285941 7.305945 6.202785 4.933215 8.268469 8.305003 6.523939 5.344932 6.582716 6.804374 4.182906 7.853672 5.487833 7.503588 2.230752 0.000000 6.645051 7.862772 3.722126 6.171845 5.880709 4.480563 4.866567 6.803220 6.581196 5.343257 4.181478 7.852609 7.501923 5.485813 6.203845 7.306756 7.286345 4.934118 8.268709 6.525390 8.305944 2.230695 1.365768 0.000000 7.564284 8.769514 4.694907 6.677629 7.190080 5.916376 5.262749 8.339881 8.388432 7.285585 6.018210 9.305120 9.389233 7.584253 5.741084 7.068581 7.468079 4.725156 8.544198 5.678296 7.901014 3.259577 1.085218 2.228044 0.000000 7.563660 8.768835 4.694626 7.189988 6.676562 5.261701 5.916574 7.466494 7.066540 5.738912 4.723412 8.542670 7.898749 5.675668 7.286680 8.389218 8.340168 6.019117 9.305198 7.585825 9.390179 3.259524 2.228015 1.085225 2.772365 0.000000 5.403292 6.606696 2.578304 5.112438 4.539697 3.128891 3.933736 5.431586 5.238036 4.049314 2.834498 6.484196 6.189106 4.327750 5.661381 6.581064 6.342325 4.340802 7.253410 6.196678 7.637173 1.345768 2.197768 1.374211 3.264874 2.165202 0.000000 5.241545 6.389236 2.755339 5.241979 4.146782 2.754608 4.261538 4.818207 4.423690 3.144650 2.058269 5.902483 5.309542 3.319205 6.245381 7.006598 6.569555 4.933469 7.381991 6.899282 8.088849 2.035125 3.215663 2.206217 4.268266 2.666161 1.030663 0.000000 5.403891 6.607316 2.578622 4.540518 5.112745 3.933792 3.129729 6.342421 6.580880 5.660969 4.340405 7.253670 7.636929 6.195987 4.050614 5.239281 5.432666 2.835711 6.485223 4.329165 6.190399 1.345795 1.374293 2.197774 2.165272 3.264886 2.153825 3.113378 0.000000 5.243012 6.390753 2.756143 4.148461 5.243072 4.262210 2.756178 6.570469 7.007157 6.245584 4.933605 7.383147 8.089365 6.899146 3.146589 4.425679 4.820145 2.060201 5.904413 3.320987 5.311506 2.035248 2.206062 3.215521 2.665952 4.268110 3.113363 4.007254 1.030548 0.000000 5.039810 5.848387 4.082832 4.798541 4.797822 4.349874 4.350516 5.560985 5.868487 5.461831 4.750811 6.186318 6.689746 6.050561 5.463786 5.870607 5.562547 4.752089 6.187871 6.052800 6.692289 4.301429 5.352851 5.352513 6.026555 6.025820 4.722547 4.833705 4.723102 4.834874 0.000000 5.300758 6.209593 3.917616 4.649298 5.270776 4.673452 3.937101 6.291283 6.711507 6.197409 5.240894 6.951736 7.641679 6.831401 4.577502 5.229592 5.256119 3.926003 6.045515 4.973754 6.006487 3.891818 4.572965 4.918790 5.081222 5.699168 4.526855 4.938144 3.913513 3.841186 1.443355 0.000000 6.289803 7.250382 4.547774 5.613034 6.135619 5.363694 4.738649 7.133294 7.406520 6.731229 5.741273 7.867299 8.321157 7.234556 5.284650 6.102023 6.243424 4.578034 7.082758 5.522693 6.856944 4.153214 4.301893 4.666533 4.654305 5.319698 4.568540 5.069739 3.964122 4.013396 2.094638 1.101692 0.000000 5.557383 6.334328 4.593803 4.784019 5.795430 5.397803 4.258252 6.839203 7.417996 7.050378 6.124283 7.372854 8.339002 7.756718 4.405972 4.930592 5.101544 4.072755 5.823471 4.701391 5.549711 4.731784 5.379450 5.885125 5.777289 6.703598 5.513463 5.957169 4.627624 4.333066 2.094179 1.101234 1.778679 0.000000 4.667583 5.683585 2.975123 3.866141 4.668155 3.970816 2.954454 5.833177 6.311749 5.753737 4.663519 6.544819 7.317023 6.453551 3.704975 4.493367 4.555615 2.892595 5.454888 4.159430 5.362693 2.948896 3.809538 4.261028 4.395752 5.168968 3.795806 4.306053 2.943042 2.802017 2.145088 1.112262 1.790639 1.783702 0.000000 4.024158 4.644865 3.963788 3.994612 3.992307 3.974007 3.976224 4.677386 5.231597 5.165204 4.619422 5.116376 6.022217 5.923552 5.170375 5.237046 4.681559 4.623177 5.120313 5.929224 6.028384 4.677278 6.169726 6.168798 6.934261 6.932493 5.287968 5.267827 5.289603 5.271114 1.444890 2.401102 3.352953 2.642767 2.747389 0.000000 4.345630 4.800180 4.623329 4.137789 4.654250 4.796632 4.282214 5.385267 6.106851 6.158121 5.595687 5.668910 6.881969 6.967107 5.006675 4.925570 4.494209 4.736379 4.843862 5.691072 5.561134 5.388164 6.782639 6.958397 7.453217 7.775052 6.147595 6.227744 5.829533 5.630272 2.096109 2.638477 3.631247 2.399157 3.073951 1.100898 0.000000 4.347837 4.802966 4.623484 4.658317 4.136734 4.280309 4.799619 4.490877 4.919811 5.000584 4.731962 4.841283 5.554399 5.683907 6.164090 6.113890 5.391542 5.599811 5.675548 6.973379 6.889983 5.387373 6.957704 6.779797 7.775087 7.449128 5.826418 5.625420 6.148210 6.230362 2.096065 3.352045 4.175759 3.630198 3.767472 1.100899 1.778889 0.000000 2.960885 3.705826 3.039075 2.967237 2.964122 3.015112 3.018126 3.816764 4.512230 4.486249 3.864648 4.303379 5.399529 5.365930 4.492186 4.518427 3.821763 3.869223 4.307877 5.372178 5.406212 4.004615 5.768010 5.766959 6.610165 6.608247 4.744698 4.703387 4.746622 4.707265 2.143078 2.751911 3.768300 3.092099 2.633969 1.111520 1.786245 1.786252 0.000000 5.303666 6.212835 3.918742 5.273303 4.651826 3.938932 4.675052 5.258355 5.231097 4.578418 3.926980 6.047962 6.007711 4.973974 6.199109 6.714072 6.294234 5.242007 6.955094 6.832784 7.644496 3.891338 4.916405 4.570361 5.696564 5.077956 3.912089 3.840157 4.525613 4.937544 1.443330 2.403532 2.637961 3.352865 2.766045 2.401074 3.352019 2.638075 2.752201 0.000000 5.562541 6.340193 4.595732 5.799948 4.788366 4.261098 5.400794 5.105654 4.933264 4.407240 4.073984 5.828118 5.551975 4.701279 7.053600 7.422551 6.844386 6.126603 7.378744 7.759461 8.343945 4.731271 5.881903 5.375442 6.700044 5.771982 4.625256 4.330890 5.512145 5.956977 2.094182 3.352875 3.624465 4.172615 3.783774 2.642915 3.630098 2.398908 3.092823 1.101240 0.000000 6.292084 7.253027 4.548447 6.136871 5.615729 4.740900 5.363970 6.246492 6.105186 5.287584 4.580516 7.085870 6.860150 5.525503 6.730743 7.407000 7.134564 5.740517 7.869103 7.233511 8.321732 4.152410 4.663020 4.299461 5.315453 4.651691 3.963517 4.014304 4.565947 5.067069 2.094622 2.637800 2.390103 3.624447 3.095688 3.352946 4.175765 3.631056 3.768432 1.101693 1.778683 0.000000 4.671050 5.687280 2.976800 4.671263 3.869243 2.956860 3.973042 4.558264 4.495107 3.705950 2.893703 5.457734 5.364091 4.159462 5.755886 6.314709 5.836566 4.665156 6.548522 6.455348 7.320148 2.948403 4.258395 3.806302 5.166212 4.391797 2.941003 2.800279 3.794585 4.305745 2.145086 2.766244 3.096241 3.783837 2.668749 2.747201 3.767502 3.073097 2.634123 1.112266 1.783662 1.790651 0.000000 0.2665889 0.2415357 0.1870063 NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 454 454 454 454 454 MxSgAt= 43 MxSgA2= 43. 1 open 1 1 1 -1032.03586927093 -1032.03586927 1 0.7798 1.021172375255e+03 -6.464213571910e+03 2.376871055914e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 1572864000 LenX= 1572439727 LenY= 1572232247 Requested convergence on RMS density matrix=1.00D-08 within 32 cycles. Requested convergence on MAX density matrix=1.00D-06. Requested convergence on energy=1.00D-06. No special actions if energy rises. Fock matrices will be formed incrementally for 20 cycles. 0.7798 Using compressed storage, NAtomX= 43. Will process 44 centers per pass. Symmetrizing basis deriv contribution to polar: IMax=3 JMax=2 DiffMx= 0.00D+00 Minotr: UHF open shell wavefunction. IDoAtm=1111111111111111111111111111111111111111111 Direct CPHF calculation. Differentiating once with respect to electric field. with respect to dipole field. Differentiating once with respect to nuclear coordinates. Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum. Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum. NewPWx=T KeepS1=F KeepF1=F KeepIn=T MapXYZ=F SortEE=F KeepMc=T. 12983 words used for storage of precomputed grid. Two-electron integral symmetry not used. MDV= 1572864000 using IRadAn= 1. Solving linear equations simultaneously, MaxMat= 384. FoF2E skips out because all densities are zero. CalDSu exits because no D1Ps are significant. FoFJK: IHMeth= 1 ICntrl= 0 DoSepK=T KAlg= 0 I1Cent= 0 FoldK=F IRaf= 1 NMat= 129 IRICut= 1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=3 IntGTp=3. FoFCou: FMM=F IPFlag= 0 FMFlag= 100000 FMFlg1= 0 NFxFlg= 0 DoJE=F BraDBF=F KetDBF=F FulRan=T wScrn= 0.000000 ICntrl= 500 IOpCl= 0 I1Cent= 0 NGrid= 0 NMat0= 129 NMatS0= 129 NMatT0= 0 NMatD0= 129 NMtDS0= 0 NMtDT0= 0 Symmetry not used in FoFCou. There are 132 degrees of freedom in the 1st order CPHF. IDoFFX=6 NUNeed= 3. 129 vectors produced by pass 0 Test12= 5.86D-14 1.00D-09 XBig12= 3.52D+02 8.63D+00. AX will form 129 AO Fock derivatives at one time. 129 vectors produced by pass 1 Test12= 5.86D-14 1.00D-09 XBig12= 5.61D+01 1.71D+00. 129 vectors produced by pass 2 Test12= 5.86D-14 1.00D-09 XBig12= 1.52D+00 2.29D-01. 129 vectors produced by pass 3 Test12= 5.86D-14 1.00D-09 XBig12= 4.13D-02 4.55D-02. 129 vectors produced by pass 4 Test12= 5.86D-14 1.00D-09 XBig12= 5.27D-04 2.95D-03. 129 vectors produced by pass 5 Test12= 5.86D-14 1.00D-09 XBig12= 4.58D-06 2.35D-04. 129 vectors produced by pass 6 Test12= 5.86D-14 1.00D-09 XBig12= 3.70D-08 2.06D-05. 88 vectors produced by pass 7 Test12= 5.86D-14 1.00D-09 XBig12= 3.14D-10 1.08D-06. 30 vectors produced by pass 8 Test12= 5.86D-14 1.00D-09 XBig12= 2.64D-12 1.22D-07. 3 vectors produced by pass 9 Test12= 5.86D-14 1.00D-09 XBig12= 2.56D-14 1.15D-08. 1 vectors produced by pass 10 Test12= 5.86D-14 1.00D-09 XBig12= 2.81D-16 1.04D-09. InvSVY: IOpt=1 It= 1 EMax= 1.78D-14 Solved reduced A of dimension 1025 with 132 vectors. FullF1: Do perturbations 1 to 3. Isotropic polarizability for W= 0.000000 248.75 Bohr**3. End of Minotr F.D. properties file 721 does not exist. 296.860 -4.348 303.778 -49.729 -12.125 145.608 320.570 -4.831 327.423 -54.236 -11.628 170.939 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 C O B C C C C C C C N H H H C C C N H H H C C C H H N H N H N C H H H C H H H C H H H 13 17 11 13 13 13 13 13 13 13 14 1 1 1 13 13 13 14 1 1 1 13 13 13 1 1 14 1 14 1 14 13 1 1 1 13 1 1 1 13 1 1 1 -0.01828 0.05335 0.04186 0.01915 0.01915 -0.03391 -0.03392 -0.01771 0.02043 -0.01733 0.02417 0.00083 -0.00163 0.00080 -0.01732 0.02042 -0.01771 0.02418 0.00083 0.00080 -0.00163 -0.03302 -0.00105 -0.00106 -0.00034 -0.00034 0.02468 -0.00132 0.02468 -0.00132 0.00242 0.00097 0.00003 0.00006 0.00014 0.00021 0.00004 0.00004 0.00015 0.00094 0.00006 0.00003 0.00014 -20.54834 -32.33818 60.03996 21.52522 21.53077 -38.11578 -38.13199 -19.90911 22.96259 -19.47967 7.80989 3.70340 -7.27026 3.59056 -19.47540 22.95820 -19.90505 7.81220 3.70320 3.58888 -7.26825 -37.11905 -1.17493 -1.19117 -1.51392 -1.50910 7.97566 -5.91901 7.97404 -5.91991 0.78074 1.08891 0.14080 0.28052 0.63952 0.23466 0.20065 0.19970 0.66595 1.05341 0.27829 0.13615 0.61895 -7.33216 -11.53907 21.42375 7.68073 7.68271 -13.60066 -13.60644 -7.10406 8.19362 -6.95083 2.78676 1.32147 -2.59421 1.28120 -6.94931 8.19206 -7.10262 2.78759 1.32139 1.28060 -2.59349 -13.24500 -0.41924 -0.42504 -0.54020 -0.53848 2.84591 -2.11205 2.84534 -2.11237 0.27859 0.38855 0.05024 0.10010 0.22820 0.08373 0.07160 0.07126 0.23763 0.37588 0.09930 0.04858 0.22086 -6.85419 -10.78686 20.02717 7.18004 7.18189 -12.71405 -12.71946 -6.64096 7.65949 -6.49772 2.60510 1.23532 -2.42510 1.19768 -6.49629 7.65803 -6.63961 2.60587 1.23525 1.19712 -2.42443 -12.38158 -0.39191 -0.39733 -0.50499 -0.50338 2.66039 -1.97437 2.65985 -1.97467 0.26043 0.36322 0.04697 0.09357 0.21332 0.07827 0.06693 0.06661 0.22214 0.35138 0.09283 0.04542 0.20646 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 0.014271 -0.198736 -0.088594 -0.039501 -0.040203 0.009138 0.008699 0.018238 -0.041562 0.021782 -0.064153 -0.003317 -0.005434 0.000280 0.022780 -0.040265 0.018056 -0.063324 -0.003007 0.001194 -0.003556 0.008773 -0.005797 -0.005682 0.001280 0.002048 -0.071158 -0.002809 -0.071509 -0.001680 -0.001156 -0.001683 0.000371 -0.000692 -0.001204 -0.001395 -0.000885 -0.000892 -0.001461 -0.001477 -0.000584 0.000515 -0.000404 -0.004796 -0.278251 -0.124531 -0.059866 -0.060092 0.014090 0.014989 0.035629 -0.054516 0.034528 -0.081072 0.006404 0.006654 0.001710 0.031735 -0.054180 0.034697 -0.079005 0.005865 0.000358 0.003859 0.004466 -0.011098 -0.011351 0.000239 -0.000797 -0.093039 0.007408 -0.090611 0.005815 -0.002137 -0.002746 -0.001145 -0.000599 -0.001776 -0.002437 -0.001159 -0.000881 -0.004027 -0.002583 -0.000213 -0.001050 -0.001215 -0.009475 0.476987 0.213125 0.099368 0.100295 -0.023227 -0.023688 -0.053867 0.096078 -0.056310 0.145226 -0.003087 -0.001220 -0.001991 -0.054515 0.094446 -0.052753 0.142329 -0.002858 -0.001552 -0.000303 -0.013239 0.016895 0.017034 -0.001519 -0.001251 0.164197 -0.004599 0.162120 -0.004135 0.003293 0.004429 0.000773 0.001291 0.002979 0.003832 0.002044 0.001773 0.005487 0.004061 0.000796 0.000535 0.001619 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 -0.002298 0.019174 0.008215 0.006607 0.001650 0.000788 -0.002263 -0.000844 -0.000215 -0.005445 0.003265 -0.000346 -0.005459 -0.003151 0.001102 0.008749 -0.002200 0.009007 0.001736 0.002976 0.007144 -0.001284 -0.000020 0.000527 -0.002826 0.002363 0.006097 -0.003298 0.003786 0.004399 0.000105 -0.000411 -0.000469 -0.000255 -0.002314 0.000032 0.000018 -0.000013 -0.000286 0.000836 0.000464 0.000521 0.002991 -0.008835 0.255231 0.110723 0.057077 0.057257 -0.011911 -0.011496 -0.028271 0.053738 -0.029646 0.074554 0.000119 0.001937 -0.000719 -0.030952 0.053405 -0.028533 0.075012 -0.000175 -0.001495 0.000333 -0.009643 0.006855 0.006689 -0.000547 -0.001166 0.065599 -0.000630 0.066604 -0.001567 0.001806 0.002989 0.001423 0.000796 0.003926 0.001133 0.000094 0.000199 -0.000852 0.002950 0.000910 0.001414 0.003884 0.000204 0.056601 0.025641 0.014133 0.009345 -0.003965 -0.001937 -0.003939 0.006835 -0.002125 0.009644 -0.000355 0.001544 0.000872 -0.011085 0.015110 -0.009545 0.024027 -0.001478 -0.001267 -0.002930 -0.001052 0.002854 0.001802 0.000606 -0.000696 0.015525 0.000098 0.025802 -0.002147 0.000409 -0.000316 -0.000527 -0.001144 -0.003255 0.000549 -0.000381 0.000953 0.001033 0.001255 0.001303 0.000664 0.003420 0.3187 0.0706 0.9452 0.0731 0.9924 -0.0988 0.945 -0.1006 -0.3112 -0.0124 -0.005 0.0174 -1.669 -0.669 2.338 -0.596 -0.239 0.834 -0.557 -0.223 0.78 1 C 13 0.9456 -0.1004 -0.3095 0.0731 0.9924 -0.0985 0.3171 0.0705 0.9458 -0.2843 -0.2825 0.5668 20.573 20.438 -41.012 7.341 7.293 -14.634 6.863 6.818 -13.68 2 O 17 0.0804 0.9916 -0.1011 0.9472 -0.1076 -0.3021 0.3105 0.0715 0.9479 -0.1265 -0.1248 0.2513 -21.655 -21.376 43.031 -7.727 -7.627 15.354 -7.223 -7.13 14.353 3 B 11 -0.5413 0.8325 0.1184 0.7705 0.5474 -0.3266 0.3367 0.0855 0.9377 -0.0622 -0.059 0.1211 -8.34 -7.917 16.257 -2.976 -2.825 5.801 -2.782 -2.641 5.423 4 C 13 0.6547 0.7055 -0.2714 -0.6778 0.7069 0.2022 0.3344 0.0516 0.941 -0.0622 -0.059 0.1212 -8.341 -7.917 16.258 -2.976 -2.825 5.801 -2.782 -2.641 5.423 5 C 13 0.3069 0.0847 0.948 0.7884 -0.5805 -0.2034 0.5331 0.8098 -0.2449 -0.0274 0.0116 0.0158 -3.682 1.561 2.121 -1.314 0.557 0.757 -1.228 0.521 0.708 6 C 13 0.3055 0.0596 0.9503 0.8608 0.4094 -0.3024 -0.407 0.9104 0.0738 -0.0275 0.0117 0.0158 -3.691 1.565 2.126 -1.317 0.558 0.759 -1.231 0.522 0.709 7 C 13 0.3259 0.0402 0.9445 0.9443 -0.0621 -0.3232 0.0457 0.9973 -0.0582 -0.0638 0.028 0.0358 -8.56 3.753 4.807 -3.054 1.339 1.715 -2.855 1.252 1.603 8 C 13 0.8771 0.3619 -0.3158 -0.354 0.9314 0.0844 0.3247 0.0377 0.9451 -0.061 -0.0538 0.1148 -8.186 -7.221 15.407 -2.921 -2.577 5.498 -2.73 -2.409 5.139 9 C 13 0.3204 0.0372 0.9465 0.7592 0.5875 -0.2801 -0.5666 0.8083 0.16 -0.0664 0.0285 0.0379 -8.914 3.825 5.089 -3.181 1.365 1.816 -2.973 1.276 1.697 10 C 13 0.9525 -0.0266 -0.3034 0.013 0.9988 -0.0468 0.3043 0.0406 0.9517 -0.088 -0.0815 0.1695 -3.394 -3.143 6.536 -1.211 -1.121 2.332 -1.132 -1.048 2.18 11 N 14 0.9305 0.0196 -0.3659 0.3647 0.0482 0.9299 -0.0359 0.9986 -0.0377 -0.0034 -0.0031 0.0064 -1.799 -1.632 3.431 -0.642 -0.582 1.224 -0.6 -0.544 1.144 12 H 1 0.8802 0.3534 -0.3168 0.3232 0.0426 0.9454 -0.3476 0.9345 0.0767 -0.0083 -5.0E-4 0.0088 -4.441 -0.26 4.701 -1.585 -0.093 1.678 -1.481 -0.087 1.568 13 H 1 0.7743 0.5471 0.3181 -0.1498 -0.3299 0.9321 -0.6149 0.7693 0.1734 -0.0022 -0.0022 0.0044 -1.196 -1.165 2.361 -0.427 -0.416 0.842 -0.399 -0.389 0.788 14 H 1 0.325 0.1025 0.9402 -0.6615 0.7351 0.1485 0.6758 0.6702 -0.3067 -0.0664 0.0285 0.0379 -8.913 3.825 5.088 -3.18 1.365 1.816 -2.973 1.276 1.697 15 C 13 0.8105 -0.5403 -0.226 0.4845 0.8354 -0.2597 0.3291 0.101 0.9389 -0.061 -0.0538 0.1148 -8.184 -7.22 15.404 -2.92 -2.576 5.496 -2.73 -2.408 5.138 16 C 13 0.33 0.0984 0.9388 0.9386 -0.1402 -0.3152 0.1006 0.9852 -0.1386 -0.0638 0.028 0.0358 -8.559 3.753 4.806 -3.054 1.339 1.715 -2.855 1.252 1.603 17 C 13 0.9418 -0.1722 -0.2888 0.1332 0.9797 -0.1498 0.3087 0.1026 0.9456 -0.088 -0.0815 0.1694 -3.393 -3.142 6.534 -1.211 -1.121 2.332 -1.132 -1.048 2.18 18 N 14 0.9129 -0.2259 -0.3398 0.3655 0.0825 0.9271 0.1814 0.9706 -0.1579 -0.0034 -0.0031 0.0064 -1.799 -1.632 3.431 -0.642 -0.582 1.224 -0.6 -0.544 1.144 19 H 1 0.691 -0.5827 0.4277 -0.0848 0.5224 0.8485 0.7178 0.6226 -0.3116 -0.0022 -0.0022 0.0044 -1.196 -1.165 2.361 -0.427 -0.416 0.842 -0.399 -0.389 0.787 20 H 1 0.8148 -0.5328 -0.2286 0.3269 0.0965 0.9401 0.4789 0.8407 -0.2528 -0.0083 -5.0E-4 0.0088 -4.44 -0.26 4.701 -1.584 -0.093 1.677 -1.481 -0.087 1.568 21 H 1 0.353 0.067 0.9332 0.0739 0.9923 -0.0992 0.9327 -0.104 -0.3454 -0.017 0.0045 0.0125 -2.276 0.601 1.676 -0.812 0.214 0.598 -0.759 0.2 0.559 22 C 13 0.1705 0.9755 -0.1392 0.9491 -0.2005 -0.2428 0.2647 0.0907 0.96 -0.0115 -0.0075 0.0191 -1.544 -1.013 2.557 -0.551 -0.361 0.912 -0.515 -0.338 0.853 23 C 13 -0.0247 0.9981 -0.0573 0.9646 0.0087 -0.2636 0.2626 0.0618 0.9629 -0.0115 -0.0075 0.019 -1.539 -1.007 2.546 -0.549 -0.359 0.908 -0.513 -0.336 0.849 24 C 13 0.5997 0.7688 -0.222 0.2573 0.0774 0.9632 0.7577 -0.6347 -0.1514 -0.0021 -0.0016 0.0038 -1.142 -0.862 2.004 -0.407 -0.308 0.715 -0.381 -0.288 0.669 25 H 1 -0.4787 0.876 0.0585 0.2572 0.0763 0.9633 0.8395 0.4762 -0.2618 -0.0021 -0.0016 0.0038 -1.139 -0.863 2.002 -0.406 -0.308 0.714 -0.38 -0.288 0.668 26 H 1 -0.3003 0.9537 0.0189 0.9201 0.2948 -0.2579 0.2515 0.0601 0.966 -0.0947 -0.0876 0.1822 -3.65 -3.378 7.029 -1.303 -1.205 2.508 -1.218 -1.127 2.345 27 N 14 0.4441 0.1119 0.889 0.8499 0.2614 -0.4575 -0.2836 0.9587 0.021 -0.0049 -0.0035 0.0084 -2.615 -1.859 4.474 -0.933 -0.663 1.596 -0.872 -0.62 1.492 28 H 1 0.4353 0.8775 -0.2011 0.8637 -0.4701 -0.1818 0.2541 0.0946 0.9626 -0.0946 -0.0876 0.1822 -3.65 -3.378 7.028 -1.303 -1.205 2.508 -1.218 -1.127 2.344 29 N 14 0.4365 0.0011 0.8997 0.7965 -0.4655 -0.3859 0.4184 0.885 -0.2041 -0.0049 -0.0035 0.0084 -2.613 -1.863 4.476 -0.932 -0.665 1.597 -0.872 -0.621 1.493 30 H 1 0.0728 0.9925 -0.0984 0.9401 -0.1013 -0.3256 0.3331 0.0688 0.9404 -0.0022 -0.0018 0.004 -0.084 -0.069 0.153 -0.03 -0.025 0.055 -0.028 -0.023 0.051 31 N 14 0.7426 0.6134 -0.2689 -0.5526 0.788 0.2717 0.3785 -0.0532 0.9241 -0.0031 -0.0026 0.0057 -0.417 -0.344 0.761 -0.149 -0.123 0.272 -0.139 -0.115 0.254 32 C 13 0.1518 0.9778 0.1445 0.7517 -0.0192 -0.6592 0.6418 -0.2087 0.7379 -0.0013 -9.0E-4 0.0022 -0.691 -0.462 1.153 -0.247 -0.165 0.411 -0.231 -0.154 0.384 33 H 1 -0.3779 0.788 0.4861 0.8802 0.4686 -0.0752 0.287 -0.3994 0.8707 -0.0012 -9.0E-4 0.0021 -0.631 -0.478 1.109 -0.225 -0.17 0.396 -0.211 -0.159 0.37 34 H 1 0.7527 0.6464 -0.1248 -0.4508 0.6442 0.6179 0.4798 -0.4089 0.7763 -0.0038 -0.0033 0.0071 -2.05 -1.75 3.799 -0.731 -0.624 1.356 -0.684 -0.584 1.267 35 H 1 0.074 0.9923 -0.0994 0.9767 -0.0922 -0.1935 0.2012 0.0828 0.976 -0.0025 -0.0016 0.0041 -0.334 -0.218 0.552 -0.119 -0.078 0.197 -0.111 -0.073 0.184 36 C 13 -0.0916 0.9887 0.1186 0.9953 0.0945 -0.0197 0.0306 -0.1162 0.9927 -0.0012 -9.0E-4 0.0021 -0.644 -0.472 1.116 -0.23 -0.168 0.398 -0.215 -0.157 0.372 37 H 1 0.2339 0.9214 -0.3105 0.9703 -0.2416 0.0139 0.0621 0.3045 0.9505 -0.0012 -9.0E-4 0.0021 -0.643 -0.473 1.116 -0.229 -0.169 0.398 -0.215 -0.158 0.372 38 H 1 0.0738 0.9923 -0.0998 0.9898 -0.0607 0.1286 -0.1216 0.1083 0.9867 -0.0042 -0.0016 0.0057 -2.215 -0.829 3.044 -0.79 -0.296 1.086 -0.739 -0.277 1.015 39 H 1 -0.6402 0.7568 0.1316 0.6582 0.6288 -0.414 0.3961 0.1784 0.9007 -0.0031 -0.0025 0.0056 -0.412 -0.34 0.752 -0.147 -0.121 0.268 -0.138 -0.113 0.251 40 C 13 -0.4791 -0.6149 0.6264 0.8021 -0.5965 0.0279 0.3565 0.5158 0.779 -0.0012 -9.0E-4 0.0021 -0.629 -0.479 1.108 -0.224 -0.171 0.395 -0.21 -0.16 0.369 41 H 1 -0.0089 0.9419 -0.3357 0.737 -0.2207 -0.6389 0.6759 0.2531 0.6922 -0.0013 -9.0E-4 0.0022 -0.689 -0.463 1.152 -0.246 -0.165 0.411 -0.23 -0.154 0.384 42 H 1 (Enter /NFS_R1/Userdata/grufor/SOFTWARE/g16/l716.exe) PT26755.300S 2024-12-17T16:36:03.000 -14.41674 -10.37086 -10.36846 -10.36514 -10.36454 -10.33847 -10.33844 -10.31314 -10.31312 -10.31044 -10.31041 -10.30486 -10.30484 -10.30272 -10.30269 -10.29925 -10.29917 -10.29832 -6.80741 -1.16035 -1.11292 -1.03347 -1.03338 -1.01862 -1.00146 -0.90125 -0.89297 -0.88863 -0.86688 -0.84112 -0.78303 -0.78037 -0.75820 -0.75551 -0.74354 -0.72936 -0.71886 -0.69495 -0.68669 -0.66262 -0.63792 -0.61442 -0.60943 -0.59506 -0.57819 -0.57450 -0.56312 -0.56026 -0.55546 -0.54805 -0.54421 -0.54170 -0.54162 -0.54033 -0.51260 -0.50139 -0.49491 -0.48934 -0.48676 -0.47768 -0.47374 -0.46630 -0.46145 -0.45770 -0.43972 -0.43657 -0.43197 -0.43156 -0.42881 -0.41318 -0.38494 -0.36926 -0.36210 -0.34760 -0.34600 -0.34221 -0.32826 -0.32235 -0.27369 -0.21357 -0.00120 0.04474 0.04990 0.05199 0.07902 0.12877 0.13414 0.14296 0.15413 0.15867 0.17050 0.17365 0.18273 0.18887 0.19162 0.19967 0.20053 0.20912 0.21035 0.21610 0.22353 0.22736 0.23053 0.24296 0.24422 0.25314 0.26105 0.26119 0.26529 0.27357 0.28261 0.28287 0.29978 0.31017 0.31943 0.33207 0.33693 0.33720 0.34396 0.34912 0.35631 0.36617 0.37029 0.37636 0.38708 0.39789 0.40453 0.40831 0.42069 0.42077 0.44529 0.46453 0.47304 0.47685 0.48653 0.48688 0.49740 0.50712 0.51112 0.52668 0.52880 0.53170 0.54159 0.54322 0.54732 0.54806 0.55223 0.56170 0.56259 0.57237 0.57920 0.58566 0.59232 0.61902 0.61903 0.63240 0.63311 0.64199 0.65245 0.65669 0.67218 0.67600 0.67998 0.68948 0.69801 0.69867 0.71301 0.71666 0.72163 0.72289 0.72317 0.72889 0.73528 0.73786 0.74066 0.74409 0.74611 0.75135 0.75551 0.75920 0.76701 0.76856 0.76875 0.77275 0.77841 0.78796 0.79294 0.79979 0.80632 0.81110 0.81369 0.82100 0.82238 0.82681 0.83472 0.84298 0.84686 0.85558 0.85573 0.87069 0.88706 0.89708 0.90627 0.91056 0.92429 0.94206 0.95285 0.95844 0.97268 0.97984 0.98581 0.99431 1.01416 1.01700 1.02683 1.03809 1.05187 1.05234 1.08387 1.10117 1.11069 1.11808 1.13513 1.14364 1.14672 1.15979 1.16590 1.17258 1.19347 1.20205 1.22141 1.22550 1.22749 1.23775 1.25305 1.26298 1.27125 1.27412 1.28818 1.29695 1.30385 1.31102 1.32154 1.32316 1.33700 1.34217 1.34952 1.35891 1.36446 1.37051 1.37205 1.38639 1.39213 1.40453 1.41235 1.41878 1.43421 1.44479 1.45878 1.46486 1.48671 1.51304 1.51994 1.57592 1.57781 1.58201 1.58469 1.58699 1.59701 1.60055 1.63988 1.64571 1.65431 1.66488 1.67832 1.70484 1.72334 1.75257 1.75410 1.76207 1.76340 1.78416 1.78576 1.79670 1.79830 1.80831 1.82303 1.82721 1.83019 1.84863 1.85279 1.85641 1.85957 1.86125 1.86217 1.87974 1.88852 1.88927 1.89582 1.90187 1.90584 1.91759 1.92029 1.92277 1.93846 1.94914 1.95344 1.95380 1.95747 1.97661 1.98075 2.00320 2.00485 2.01214 2.01894 2.01939 2.03123 2.03701 2.04370 2.04784 2.06417 2.08320 2.09415 2.09612 2.10591 2.11275 2.11700 2.12185 2.12465 2.13941 2.14182 2.15291 2.18726 2.20453 2.21504 2.22352 2.22934 2.23996 2.26995 2.28775 2.29262 2.29622 2.32332 2.32566 2.33350 2.34654 2.35976 2.36628 2.37081 2.38798 2.39940 2.40318 2.41551 2.44946 2.45255 2.47252 2.47557 2.47863 2.48448 2.50726 2.51235 2.51595 2.53004 2.53239 2.53737 2.54659 2.54791 2.56968 2.57487 2.61791 2.66137 2.67567 2.68227 2.68841 2.69331 2.73868 2.74515 2.74714 2.76079 2.76265 2.78284 2.80190 2.80556 2.81143 2.81362 2.81951 2.82712 2.82964 2.83842 2.86395 2.87087 2.89762 2.90526 2.91477 2.93179 2.94448 2.98336 2.98351 2.99062 3.00272 3.01165 3.01383 3.02893 3.05547 3.07030 3.11761 3.12402 3.15122 3.19115 3.19849 3.21265 3.24342 3.24640 3.25017 3.26708 3.27320 3.27492 3.38866 3.48958 3.49195 3.49222 3.61357 3.67287 3.72514 3.76410 3.76646 -19.22078 -14.51923 -14.51918 -14.44346 -14.44343 -14.41673 -10.37150 -10.36883 -10.36498 -10.36438 -10.33927 -10.33924 -10.31394 -10.31392 -10.31123 -10.31120 -10.30354 -10.30352 -10.30268 -10.30266 -10.29831 -10.29788 -10.29780 -6.80417 -1.15831 -1.10649 -1.03150 -1.03138 -1.01536 -1.00143 -0.89833 -0.89127 -0.88665 -0.86482 -0.84000 -0.78292 -0.78029 -0.75541 -0.75424 -0.74256 -0.72492 -0.71712 -0.69483 -0.68446 -0.66247 -0.63613 -0.61351 -0.60540 -0.59384 -0.57712 -0.56884 -0.56266 -0.55928 -0.55222 -0.54575 -0.54338 -0.54158 -0.54150 -0.53921 -0.50565 -0.49903 -0.49243 -0.48614 -0.48591 -0.47658 -0.47219 -0.46109 -0.46083 -0.45139 -0.43724 -0.43626 -0.43144 -0.43136 -0.41894 -0.41113 -0.37027 -0.36328 -0.35049 -0.34282 -0.33947 -0.33521 -0.32357 -0.31840 -0.27328 -0.02853 0.00881 0.05304 0.05918 0.06571 0.08321 0.12928 0.14205 0.14292 0.15430 0.15884 0.17078 0.18298 0.18751 0.18917 0.19293 0.20066 0.20068 0.20904 0.21014 0.21615 0.22552 0.23110 0.23282 0.24316 0.24425 0.25405 0.26118 0.26212 0.26527 0.27454 0.28289 0.28365 0.29920 0.31051 0.32291 0.33666 0.33794 0.34398 0.34757 0.35055 0.35713 0.36719 0.37063 0.37576 0.38763 0.40131 0.40559 0.40837 0.42075 0.42077 0.44654 0.46512 0.47511 0.47770 0.48650 0.49428 0.50229 0.50777 0.51385 0.52736 0.53002 0.53432 0.54373 0.54455 0.54784 0.54882 0.55260 0.56180 0.56363 0.57297 0.57993 0.58767 0.59243 0.61824 0.61900 0.63133 0.63452 0.64327 0.65419 0.65822 0.67347 0.67746 0.68343 0.69024 0.69839 0.69939 0.71347 0.71708 0.72254 0.72266 0.72430 0.72921 0.73579 0.73819 0.74116 0.74491 0.74648 0.75156 0.75588 0.75994 0.76779 0.76904 0.76949 0.77386 0.77897 0.78891 0.79405 0.80045 0.80670 0.81196 0.81408 0.82162 0.82330 0.82859 0.83546 0.84359 0.84696 0.85607 0.85736 0.87178 0.88795 0.89870 0.90821 0.91165 0.92594 0.94338 0.95259 0.96041 0.97706 0.98050 0.98659 0.99652 1.01561 1.01797 1.02852 1.04000 1.05254 1.05357 1.09232 1.10296 1.11122 1.12310 1.13704 1.15181 1.15865 1.16160 1.16720 1.17555 1.20124 1.20248 1.22230 1.22762 1.22945 1.23893 1.25572 1.26401 1.27280 1.27572 1.29048 1.29776 1.30472 1.31204 1.32286 1.32443 1.33834 1.34265 1.35119 1.36155 1.36584 1.37192 1.37365 1.38744 1.39357 1.40468 1.41405 1.42123 1.44115 1.44639 1.45957 1.46672 1.48927 1.51500 1.52164 1.57696 1.58230 1.58471 1.58662 1.58912 1.60116 1.60152 1.64138 1.64584 1.65700 1.66547 1.68155 1.70891 1.72710 1.75439 1.75455 1.76246 1.76440 1.78484 1.78618 1.79794 1.79903 1.80942 1.82450 1.82739 1.83186 1.85016 1.85535 1.85934 1.86101 1.86201 1.86311 1.88072 1.88975 1.89001 1.89693 1.90227 1.90617 1.91878 1.92049 1.92315 1.93972 1.94916 1.95385 1.95387 1.95826 1.97673 1.98082 2.00431 2.00566 2.01417 2.01953 2.02249 2.03179 2.03857 2.04726 2.05039 2.06517 2.08384 2.09425 2.09711 2.10607 2.11282 2.11823 2.12198 2.12678 2.14122 2.14223 2.15332 2.18861 2.20599 2.21560 2.22436 2.23026 2.24205 2.27027 2.28776 2.29198 2.29644 2.32519 2.32772 2.33530 2.34718 2.36056 2.36771 2.37151 2.38973 2.39951 2.40329 2.41716 2.45214 2.45407 2.47256 2.47628 2.47945 2.48659 2.50950 2.51375 2.51765 2.53074 2.53260 2.53798 2.54818 2.54957 2.57360 2.57608 2.61956 2.66299 2.67883 2.68510 2.68967 2.69620 2.74094 2.74521 2.74900 2.76088 2.76306 2.78338 2.80472 2.80787 2.81154 2.81389 2.82744 2.82876 2.83458 2.83962 2.86485 2.87832 2.90070 2.90848 2.91546 2.93361 2.94668 2.98364 2.98376 2.99198 3.00504 3.01222 3.01440 3.02905 3.05612 3.07065 3.11824 3.12464 3.15348 3.19271 3.19978 3.21362 3.24560 3.24647 3.25708 3.26839 3.27326 3.27511 3.38941 3.49079 3.49329 3.49341 3.61494 3.67384 3.72611 3.76729 3.76765 2.25351999e+00 -2.62281000e-01 -9.72934342e-01 2.96860132e+02 -4.34839396e+00 3.03778168e+02 -4.97286162e+01 -1.21248139e+01 1.45608464e+02 -2.5990 -0.0006 -0.0004 0.0006 3.4833 4.1137 22.6904 29.6157 33.5538 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A 22.6864 29.6138 33.5533 54.7555 59.8863 74.6238 75.5580 96.1691 103.9414 114.4557 156.5950 163.0148 208.0184 221.8760 238.6054 244.9999 261.8113 263.4486 288.8773 298.5870 328.6310 354.7616 375.0118 380.5841 422.5360 428.3259 432.6936 433.3476 477.8121 516.6050 580.1964 583.8541 631.3831 637.8643 665.2031 698.3621 728.7830 743.6086 758.1140 776.8447 785.1503 807.7600 831.5935 865.7198 872.1295 887.0061 890.5768 905.9720 908.7821 940.1948 960.0181 967.3407 1000.7632 1001.9031 1026.7023 1037.8673 1041.9360 1075.6774 1076.0436 1077.2134 1085.5586 1090.7794 1092.9142 1111.8350 1118.1138 1121.6602 1124.8551 1131.1288 1168.1748 1189.2160 1203.1123 1210.6098 1240.2894 1278.5194 1291.5337 1307.5371 1311.2199 1341.2873 1343.3775 1346.8566 1353.5401 1371.2378 1435.8237 1436.0592 1441.5723 1460.2681 1461.1319 1461.3102 1469.6622 1471.8794 1475.7907 1485.6161 1489.3765 1497.4201 1500.9401 1504.2199 1531.8652 1559.2610 1618.2379 1626.4643 1639.4889 1662.4235 1664.8976 1759.9291 2964.6960 2970.4827 2986.0088 3081.9403 3082.1700 3090.6446 3131.9914 3133.6517 3140.6100 3171.3238 3171.5676 3219.1043 3220.0687 3232.8193 3234.0130 3305.0650 3324.3362 3406.7022 3415.1874 4.2243 5.3878 3.0320 5.0132 6.1709 2.4079 2.4999 5.5763 4.3500 4.8175 4.9081 5.9196 5.4696 5.4422 1.6913 1.4136 1.2481 1.1819 5.6406 8.0661 2.2529 7.0695 6.8275 6.0065 10.3926 4.6690 2.0273 2.0224 4.1858 3.7913 4.6779 6.2982 3.5135 7.9220 8.1333 8.3917 3.6388 2.3266 1.9939 7.4084 2.4430 1.6947 1.7090 1.3681 3.5550 3.7234 3.3427 1.1488 1.2338 6.4701 6.9980 7.0674 1.4059 1.4233 2.2916 1.3728 1.4224 2.1917 1.2249 1.3850 1.8278 1.6549 1.6843 1.7795 1.7027 1.3223 1.3324 1.6273 1.6887 2.0534 1.7602 1.6130 2.7456 3.9445 2.1052 1.5026 6.3643 8.3465 2.8792 2.9080 4.7029 2.0593 1.2106 1.2252 2.9232 1.0409 2.3419 1.1748 1.1058 3.2912 1.0534 2.5971 1.1630 1.2469 1.0869 2.7902 4.5626 5.3499 6.2201 6.1700 3.7346 6.6731 6.6610 11.9760 1.0496 1.0499 1.0503 1.0836 1.0844 1.0858 1.1055 1.1049 1.1055 1.0915 1.0915 1.0903 1.0903 1.0992 1.0991 1.0930 1.1112 1.0855 1.0880 0.0013 0.0028 0.0020 0.0089 0.0130 0.0079 0.0084 0.0304 0.0277 0.0372 0.0709 0.0927 0.1394 0.1579 0.0567 0.0500 0.0504 0.0483 0.2773 0.4237 0.1434 0.5242 0.5657 0.5126 1.0932 0.5047 0.2236 0.2238 0.5631 0.5961 0.9278 1.2650 0.8252 1.8991 2.1204 2.4113 1.1387 0.7580 0.6752 2.6342 0.8873 0.6515 0.6963 0.6041 1.5931 1.7260 1.5621 0.5556 0.6004 3.3698 3.8000 3.8965 0.8296 0.8418 1.4233 0.8712 0.9098 1.4941 0.8356 0.9469 1.2691 1.1601 1.1853 1.2961 1.2542 0.9801 0.9933 1.2267 1.3577 1.7110 1.5012 1.3928 2.4885 3.7989 2.0689 1.5136 6.4469 8.8470 3.0614 3.1080 5.0765 2.2814 1.4704 1.4886 3.5791 1.3077 2.9457 1.4781 1.4072 4.2009 1.3518 3.3772 1.5200 1.6473 1.4426 3.7198 6.3082 7.6636 9.5969 9.6167 5.9144 10.8657 10.8784 21.8551 5.4355 5.4584 5.5176 6.0644 6.0696 6.1110 6.3890 6.3926 6.4244 6.4679 6.4687 6.6570 6.6609 6.7684 6.7730 7.0346 7.2352 7.4224 7.4770 0.0656 0.5153 0.0041 1.2755 1.7902 0.1560 1.1371 5.3180 0.6544 2.0649 0.0238 1.9188 0.8658 4.1551 0.1984 0.0030 0.3066 0.3931 4.6211 23.4179 13.4587 13.6047 0.2786 0.0224 1.5498 2.8109 0.0188 0.0767 0.0109 0.0529 13.0452 8.9478 0.0131 2.3495 5.0564 0.7653 10.8600 0.1594 55.5380 11.2141 0.0864 36.3484 0.1372 0.5156 27.5333 19.0461 10.2829 0.8554 132.9243 1.3489 15.8106 10.5394 0.0381 0.8798 18.1539 0.0007 0.1078 8.4902 0.4778 14.3472 1.6530 7.2019 5.2069 7.7712 13.4986 8.1611 8.8123 60.0900 7.5934 34.7505 4.1437 21.0367 39.5695 3.8499 0.4844 2.4369 146.8764 0.6197 8.9845 11.6632 41.3096 0.4019 0.8751 1.9329 178.8180 9.5509 1.6965 19.4777 16.7255 49.9755 0.7315 23.9405 7.8779 0.9169 1.8388 18.6973 43.0595 102.5119 0.0627 254.4441 235.0419 55.4102 208.8898 345.0824 31.8129 42.6686 77.0931 61.4241 32.7142 40.5420 6.8897 25.2798 17.8962 47.3045 14.4980 0.8935 0.5581 11.9479 8.5774 5.5190 1.9466 316.8870 105.1397 -0.00 -0.02 -0.00 -0.00 -0.01 -0.00 -0.00 -0.04 0.00 -0.02 -0.03 -0.03 0.01 -0.02 0.04 0.01 -0.03 0.03 -0.02 -0.03 -0.03 0.04 -0.02 0.07 0.05 -0.02 0.11 0.05 -0.03 0.10 0.03 -0.03 0.07 0.04 -0.01 0.08 0.07 -0.02 0.14 0.06 -0.03 0.13 -0.06 -0.04 -0.09 -0.06 -0.03 -0.10 -0.04 -0.03 -0.07 -0.04 -0.04 -0.05 -0.05 -0.02 -0.08 -0.07 -0.05 -0.11 -0.08 -0.03 -0.14 -0.00 -0.05 0.01 -0.02 -0.07 -0.00 0.01 -0.07 0.03 -0.03 -0.08 -0.02 0.02 -0.07 0.05 0.01 -0.05 0.03 0.03 -0.05 0.05 -0.02 -0.06 -0.02 -0.04 -0.05 -0.04 0.02 0.17 -0.02 0.14 0.22 -0.03 0.15 0.34 -0.07 0.25 0.17 -0.02 0.14 0.18 -0.02 0.01 0.02 -0.00 0.10 -0.02 0.01 -0.09 -0.00 -0.01 0.00 -0.05 0.00 -0.10 0.24 -0.02 -0.21 0.21 -0.02 -0.09 0.36 -0.01 -0.09 0.20 -0.02 -0.07 0.00 -0.06 -0.08 0.00 -0.10 -0.04 0.01 0.03 -0.06 0.01 -0.03 -0.06 0.00 -0.04 -0.05 0.01 0.00 -0.05 0.01 0.01 -0.07 0.00 -0.07 -0.07 0.00 -0.06 -0.05 0.01 -0.01 -0.04 0.01 0.02 -0.09 0.00 -0.11 -0.08 0.00 -0.08 -0.05 0.01 0.01 -0.05 0.01 0.01 -0.07 0.01 -0.03 -0.07 0.00 -0.05 -0.04 0.01 0.04 -0.08 0.00 -0.09 -0.04 0.01 0.03 -0.07 0.01 -0.05 -0.03 0.01 0.07 0.00 0.02 0.18 -0.00 0.02 0.17 0.01 0.02 0.22 0.01 0.02 0.21 -0.02 0.01 0.10 -0.02 0.01 0.09 -0.02 0.02 0.11 -0.02 0.01 0.10 0.21 -0.04 -0.07 0.22 -0.03 -0.08 0.22 -0.01 -0.12 0.26 -0.04 -0.07 0.18 -0.04 -0.07 0.21 -0.06 -0.06 0.22 -0.07 -0.07 0.21 -0.06 -0.04 0.21 -0.05 -0.06 0.19 -0.02 -0.06 0.21 -0.04 -0.03 0.19 -0.03 -0.10 0.16 0.01 -0.05 -0.01 -0.03 -0.00 -0.01 -0.04 -0.00 -0.00 -0.01 0.00 -0.01 -0.03 -0.02 -0.01 -0.02 0.02 -0.01 -0.02 0.02 -0.00 -0.02 -0.01 -0.01 -0.03 0.04 -0.00 -0.02 0.07 -0.00 -0.01 0.06 -0.00 -0.01 0.04 -0.01 -0.03 0.04 -0.00 -0.02 0.09 -0.00 -0.01 0.08 -0.01 -0.03 -0.06 -0.01 -0.03 -0.07 -0.01 -0.03 -0.04 -0.00 -0.02 -0.03 -0.01 -0.04 -0.05 -0.01 -0.02 -0.07 -0.01 -0.04 -0.09 -0.00 -0.01 0.01 0.00 -0.00 0.01 -0.00 0.00 0.01 0.00 0.00 0.01 -0.00 0.00 0.02 -0.00 -0.00 0.01 -0.00 -0.00 0.02 0.00 -0.01 0.00 0.00 -0.01 -0.01 0.02 0.08 -0.01 -0.15 -0.00 0.06 -0.16 -0.16 0.08 -0.28 0.09 0.08 -0.16 -0.00 0.06 0.04 0.28 -0.03 -0.07 0.38 0.03 0.16 0.35 -0.10 0.03 0.27 -0.03 0.18 -0.04 -0.06 0.32 0.02 -0.10 0.16 -0.20 -0.07 0.17 -0.03 -0.06 0.03 0.00 0.08 0.07 0.01 0.19 -0.03 -0.01 -0.11 0.01 0.00 0.02 0.01 0.00 0.02 -0.02 -0.01 -0.07 -0.02 -0.01 -0.07 0.04 0.00 0.08 0.03 0.00 0.05 -0.00 -0.00 -0.04 -0.02 -0.01 -0.09 0.06 0.01 0.15 0.04 0.00 0.09 -0.01 -0.01 -0.05 -0.00 -0.00 -0.04 0.03 0.00 0.05 0.04 0.01 0.08 -0.02 -0.01 -0.09 0.06 0.01 0.15 -0.01 -0.00 -0.06 0.04 0.01 0.09 -0.01 -0.00 -0.04 0.06 0.02 0.22 0.06 0.02 0.22 0.09 0.02 0.32 0.09 0.03 0.32 0.02 0.00 0.05 0.01 0.00 0.02 0.02 0.00 0.05 0.01 0.00 0.02 -0.05 -0.01 -0.15 -0.10 -0.01 -0.19 -0.10 -0.02 -0.28 -0.05 -0.01 -0.16 -0.19 -0.01 -0.16 -0.04 0.00 -0.04 0.00 0.00 -0.01 0.01 0.00 -0.01 -0.12 0.02 0.00 -0.09 -0.01 -0.18 -0.03 -0.01 -0.14 -0.09 -0.03 -0.28 -0.18 0.02 -0.15 0.05 0.01 0.15 0.10 0.02 0.30 0.02 0.00 0.05 0.01 0.00 0.03 0.01 0.00 0.03 0.00 0.00 0.01 0.00 0.00 0.01 -0.02 -0.00 -0.07 -0.07 -0.01 -0.21 -0.07 -0.01 -0.21 -0.03 -0.00 -0.10 -0.02 0.00 -0.05 -0.11 -0.01 -0.32 -0.10 -0.01 -0.31 -0.07 -0.02 -0.21 -0.07 -0.02 -0.21 -0.03 -0.01 -0.07 -0.03 -0.01 -0.10 -0.02 -0.01 -0.05 -0.11 -0.03 -0.31 -0.11 -0.04 -0.32 0.01 0.00 0.04 0.00 0.00 0.01 0.00 0.00 0.01 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.01 0.00 0.03 0.00 0.00 0.00 0.01 0.00 0.03 0.00 -0.00 0.00 0.04 0.01 0.11 0.05 0.01 0.12 0.05 0.01 0.14 0.04 0.01 0.11 0.07 0.02 0.11 0.03 0.01 0.08 0.02 0.00 0.07 0.02 0.00 0.07 0.06 0.00 0.07 0.05 0.01 0.12 0.03 0.01 0.11 0.05 0.02 0.14 0.07 -0.00 0.11 0.00 0.01 -0.00 0.00 0.01 0.00 -0.00 0.01 -0.01 -0.00 0.01 -0.01 0.00 0.01 0.01 -0.00 0.01 -0.01 0.00 0.01 0.00 0.01 0.01 0.04 0.01 0.01 0.04 -0.00 0.01 0.00 -0.01 0.01 -0.02 0.02 0.01 0.06 0.02 0.01 0.06 -0.00 0.01 -0.01 0.00 0.01 -0.00 -0.01 0.00 -0.04 -0.01 0.00 -0.04 0.01 0.01 0.02 -0.02 0.00 -0.05 0.00 0.01 0.01 -0.02 0.00 -0.06 -0.00 0.01 -0.00 0.01 0.02 0.03 -0.01 0.01 -0.02 0.02 0.02 0.06 -0.01 0.01 -0.04 -0.01 0.01 -0.04 -0.02 0.00 -0.06 0.01 0.01 0.04 0.02 0.01 0.06 0.00 0.03 -0.00 0.07 -0.04 0.22 0.07 0.03 0.22 0.13 0.06 0.37 0.07 -0.24 0.26 -0.00 -0.04 -0.00 0.06 0.07 0.17 -0.06 0.04 -0.21 -0.01 -0.28 0.02 -0.07 -0.07 -0.21 -0.12 -0.00 -0.37 -0.07 -0.01 -0.21 -0.10 -0.28 -0.21 0.00 -0.00 -0.01 -0.01 -0.00 -0.05 0.03 0.00 0.06 0.01 0.00 0.01 0.01 0.00 0.01 0.02 0.00 0.04 0.02 0.00 0.04 -0.01 -0.00 -0.04 -0.01 -0.00 -0.05 -0.00 0.00 -0.01 0.01 0.00 0.03 -0.02 -0.00 -0.07 -0.03 -0.00 -0.08 -0.00 0.00 -0.01 -0.00 -0.00 -0.01 -0.01 -0.00 -0.05 -0.01 -0.00 -0.04 0.01 0.00 0.03 -0.02 -0.01 -0.07 -0.00 -0.00 -0.01 -0.03 -0.01 -0.08 0.02 0.00 0.04 0.00 -0.00 -0.03 -0.00 -0.00 -0.04 -0.01 -0.00 -0.06 -0.01 -0.00 -0.07 0.01 0.00 0.01 0.01 0.00 0.02 0.01 0.00 0.01 0.02 0.00 0.02 0.04 -0.00 -0.01 -0.07 -0.01 -0.10 -0.07 -0.02 -0.32 0.06 -0.00 -0.01 -0.29 -0.01 -0.02 0.06 0.02 0.26 0.17 0.02 0.33 0.16 0.02 0.33 -0.13 0.04 0.36 -0.08 -0.00 -0.11 0.04 -0.01 -0.03 -0.08 -0.03 -0.34 -0.30 0.03 -0.04 -0.02 -0.01 -0.08 -0.03 -0.01 -0.08 -0.07 -0.02 -0.21 -0.02 -0.00 -0.06 -0.02 -0.01 -0.06 -0.05 -0.01 -0.15 -0.05 -0.01 -0.15 0.03 0.00 0.06 0.04 0.00 0.09 -0.00 -0.01 -0.02 -0.04 -0.01 -0.13 0.05 0.01 0.14 0.07 0.01 0.19 0.00 -0.01 -0.01 0.00 0.00 -0.02 0.04 0.01 0.09 0.03 0.01 0.06 -0.04 -0.01 -0.13 0.05 0.01 0.14 0.01 0.00 -0.01 0.08 0.02 0.20 -0.05 -0.01 -0.14 0.01 0.01 0.08 0.01 0.01 0.08 0.03 0.01 0.17 0.03 0.01 0.17 -0.03 -0.00 -0.07 -0.04 -0.01 -0.08 -0.03 -0.01 -0.07 -0.04 -0.01 -0.08 0.09 0.01 0.19 0.04 0.02 0.13 0.04 0.00 0.05 0.07 0.01 0.13 -0.04 0.06 0.14 0.09 0.02 0.27 0.12 0.01 0.28 0.12 0.01 0.29 0.04 0.03 0.29 0.04 0.01 0.14 0.06 0.01 0.15 0.04 0.01 0.07 -0.04 -0.01 0.16 -0.00 0.00 0.00 -0.00 -0.02 0.00 0.00 0.04 -0.00 0.03 0.01 0.02 -0.03 0.01 -0.03 0.00 0.04 0.05 0.00 0.03 -0.06 -0.08 -0.00 -0.12 -0.09 0.01 -0.10 -0.03 0.04 0.07 0.01 0.05 0.13 -0.12 -0.02 -0.22 -0.13 0.00 -0.17 -0.02 0.05 0.13 0.04 0.02 -0.07 0.09 0.02 0.09 0.08 0.01 0.12 -0.01 0.03 -0.14 0.11 0.00 0.22 0.03 0.02 -0.14 0.13 0.02 0.17 0.00 0.01 -0.00 -0.07 -0.11 -0.09 0.06 -0.10 0.11 -0.14 -0.16 -0.19 0.12 -0.14 0.22 0.10 -0.02 0.16 0.19 0.00 0.24 -0.10 -0.04 -0.15 -0.19 -0.01 -0.24 0.00 0.02 -0.00 0.02 -0.01 0.08 0.02 0.01 0.08 0.03 0.03 0.13 0.02 -0.08 0.09 0.00 0.00 -0.00 0.02 0.05 0.08 -0.01 0.04 -0.09 -0.01 -0.10 0.01 -0.02 -0.02 -0.08 -0.02 0.01 -0.13 -0.02 -0.01 -0.09 -0.04 -0.09 -0.07 -0.00 -0.00 -0.00 0.00 0.04 -0.00 -0.01 -0.09 0.01 -0.03 -0.02 0.03 0.03 -0.03 -0.03 0.04 -0.07 0.02 -0.05 -0.07 -0.01 0.05 -0.01 -0.10 0.09 -0.03 -0.09 0.11 -0.07 0.01 0.08 -0.09 0.06 0.03 0.02 -0.15 0.10 -0.02 -0.14 0.16 -0.10 0.04 -0.12 -0.06 0.00 -0.09 -0.00 0.09 -0.05 0.01 0.10 -0.09 -0.09 -0.04 -0.03 0.05 0.14 -0.17 -0.08 -0.02 -0.10 0.02 0.14 -0.00 -0.03 0.00 0.08 0.20 -0.10 -0.05 0.23 0.06 0.15 0.29 -0.19 -0.10 0.34 0.13 -0.09 0.08 0.11 -0.22 0.04 0.21 0.10 0.04 -0.12 0.22 -0.03 -0.21 0.00 0.01 -0.00 0.01 0.00 0.04 0.01 0.01 0.04 0.01 0.02 0.06 0.01 -0.03 0.04 0.00 0.00 -0.00 0.01 0.03 0.04 -0.01 0.02 -0.05 -0.00 -0.05 0.00 -0.01 -0.01 -0.04 -0.01 0.01 -0.06 -0.01 -0.00 -0.04 -0.01 -0.04 -0.03 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.01 -0.00 -0.04 0.02 0.00 0.04 -0.02 -0.01 -0.05 0.02 0.00 0.05 0.05 0.01 0.15 0.02 0.00 0.05 -0.04 -0.01 -0.15 -0.05 -0.01 -0.16 0.10 0.02 0.27 0.05 0.00 0.11 -0.08 -0.02 -0.27 0.04 0.01 0.14 -0.02 -0.01 -0.05 -0.05 -0.01 -0.14 0.05 0.01 0.16 -0.09 -0.02 -0.26 0.08 0.02 0.26 -0.05 -0.01 -0.11 0.00 0.00 0.00 -0.04 -0.01 -0.15 0.04 0.02 0.15 -0.07 -0.02 -0.29 0.07 0.03 0.29 0.06 0.02 0.23 0.06 0.02 0.26 -0.06 -0.01 -0.23 -0.07 -0.02 -0.26 -0.00 0.00 -0.00 -0.00 -0.01 0.01 -0.00 -0.02 0.03 -0.02 0.00 0.00 0.02 -0.01 0.00 0.00 0.01 -0.00 -0.00 0.02 0.00 0.01 0.01 -0.01 0.00 0.00 -0.00 0.00 -0.01 -0.01 0.02 -0.00 -0.00 -0.00 -0.02 -0.04 -0.02 -0.00 -0.00 -0.01 -0.00 -0.04 0.10 0.02 0.29 -0.04 -0.01 -0.11 -0.05 -0.01 -0.16 -0.05 -0.01 -0.16 -0.02 -0.01 -0.08 -0.02 -0.00 -0.07 -0.06 -0.01 -0.19 -0.01 -0.01 -0.01 0.07 0.00 0.19 0.04 0.00 0.12 -0.10 -0.02 -0.29 -0.00 -0.01 -0.00 0.14 0.01 0.41 0.07 0.02 0.20 -0.01 0.00 -0.02 -0.07 -0.02 -0.20 0.05 0.02 0.13 -0.10 -0.02 -0.30 0.14 0.05 0.42 -0.00 0.00 -0.01 -0.03 -0.01 -0.08 -0.00 0.00 0.01 -0.00 0.00 0.02 0.01 0.00 0.05 0.01 0.00 0.06 -0.02 -0.00 -0.05 -0.00 -0.00 0.01 -0.02 -0.00 -0.06 -0.01 0.00 -0.00 0.01 0.00 0.03 0.00 0.00 0.01 0.00 0.00 -0.01 0.01 -0.00 0.01 -0.02 0.01 0.02 0.01 0.00 0.04 0.02 0.00 0.04 0.02 0.00 0.04 0.01 0.01 0.04 0.00 -0.00 0.01 0.01 0.00 0.02 0.00 -0.00 -0.01 -0.02 -0.00 0.02 -0.03 -0.01 -0.08 0.03 0.01 0.09 0.03 0.00 0.03 -0.05 -0.00 -0.14 -0.05 -0.02 -0.13 -0.04 -0.01 -0.12 -0.04 -0.01 -0.12 -0.02 -0.02 0.01 -0.00 -0.01 0.12 -0.04 0.00 0.01 -0.06 0.01 -0.10 -0.00 -0.05 0.08 0.03 -0.01 0.28 -0.05 0.01 0.03 -0.04 0.01 0.01 -0.00 0.03 0.12 -0.02 0.03 0.01 -0.06 -0.02 -0.10 0.01 0.06 0.07 -0.05 0.00 0.04 0.04 0.06 0.27 0.11 0.02 0.27 0.01 -0.02 -0.15 0.01 -0.02 -0.16 -0.04 -0.03 -0.34 -0.04 -0.03 -0.34 0.10 0.01 0.18 0.08 0.00 0.07 0.10 0.01 0.18 0.08 -0.00 0.07 0.01 -0.00 -0.01 -0.00 -0.01 0.01 0.00 0.04 -0.14 0.13 0.01 0.12 -0.14 -0.10 0.07 0.01 -0.00 -0.02 0.01 -0.00 -0.02 0.00 -0.00 -0.02 0.02 -0.01 -0.03 0.00 0.01 0.01 0.13 -0.01 0.12 -0.00 -0.06 -0.13 -0.12 0.13 0.05 -0.04 0.00 -0.00 -0.03 0.00 0.02 -0.09 0.01 0.05 -0.03 -0.03 -0.01 -0.03 0.03 -0.02 -0.04 -0.01 -0.01 -0.03 0.01 -0.01 0.09 0.10 -0.04 0.19 0.04 -0.05 0.18 -0.04 -0.05 0.06 -0.08 -0.03 0.10 0.22 -0.04 0.26 0.07 -0.05 0.24 -0.09 -0.06 0.18 0.00 -0.06 0.18 -0.07 -0.04 0.07 -0.11 -0.02 0.08 0.07 -0.05 0.06 -0.23 0.00 0.25 0.04 -0.08 0.25 -0.11 -0.03 -0.11 0.02 0.12 -0.18 0.01 0.01 -0.18 0.01 0.01 -0.19 0.01 -0.05 -0.19 0.00 -0.05 -0.14 0.02 0.10 -0.20 0.01 0.09 -0.14 0.02 0.10 -0.20 0.03 0.09 0.00 -0.00 -0.01 -0.00 -0.01 0.00 0.00 0.01 -0.05 0.05 0.00 0.05 -0.05 -0.04 0.03 0.00 -0.00 -0.01 0.00 -0.00 -0.01 0.00 -0.00 -0.01 0.01 -0.00 -0.01 -0.00 0.01 0.00 0.05 -0.00 0.05 -0.00 -0.03 -0.05 -0.05 0.05 0.02 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.03 0.01 0.09 -0.03 -0.01 -0.09 -0.03 -0.00 -0.08 0.03 0.01 0.08 -0.02 -0.00 -0.06 0.02 0.00 0.06 0.02 0.00 0.05 -0.02 -0.00 -0.05 -0.02 -0.01 -0.07 0.05 0.00 0.14 0.04 0.00 0.13 -0.02 -0.01 -0.05 -0.02 -0.01 -0.05 0.02 0.00 0.06 0.02 0.00 0.05 0.02 0.01 0.07 -0.04 -0.01 -0.13 -0.05 -0.02 -0.14 0.00 0.00 -0.00 -0.00 -0.00 -0.01 0.00 0.00 0.01 -0.01 -0.00 -0.02 0.01 0.00 0.02 0.01 0.00 0.02 0.01 0.00 0.01 -0.00 -0.00 -0.02 -0.00 0.00 -0.01 -0.00 -0.00 0.00 0.01 -0.01 0.03 0.02 0.06 -0.09 0.14 0.00 0.13 -0.09 -0.10 0.08 0.00 0.03 -0.00 -0.06 -0.24 -0.40 0.03 -0.17 0.44 0.04 0.51 -0.05 -0.01 -0.02 -0.03 -0.14 -0.00 -0.12 -0.01 0.08 0.07 0.06 -0.12 -0.05 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.02 0.01 0.07 -0.02 -0.00 -0.07 -0.02 -0.00 -0.06 0.02 0.01 0.06 -0.02 -0.00 -0.05 0.02 0.00 0.04 0.01 0.00 0.04 -0.01 -0.00 -0.04 -0.02 -0.00 -0.05 0.04 0.00 0.11 0.04 0.00 0.10 -0.02 -0.01 -0.04 -0.02 -0.00 -0.04 0.01 0.01 0.05 0.01 0.00 0.04 0.02 0.01 0.05 -0.04 -0.01 -0.10 -0.04 -0.01 -0.10 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.01 -0.00 -0.01 0.01 -0.00 0.00 0.01 0.00 0.01 0.01 0.00 -0.00 -0.00 0.00 -0.01 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.02 0.01 -0.00 0.01 -0.13 0.36 -0.29 -0.01 -0.22 0.34 0.15 -0.14 -0.00 -0.01 0.00 0.02 0.12 0.18 0.00 0.08 -0.19 -0.02 -0.21 0.03 -0.02 0.01 -0.00 0.25 -0.01 0.20 -0.03 -0.17 -0.30 -0.28 0.19 0.09 -0.00 -0.00 -0.01 0.00 0.00 0.01 0.00 -0.00 0.01 -0.02 -0.00 -0.05 0.01 0.00 0.03 0.01 0.00 0.03 -0.01 -0.00 -0.04 0.01 0.00 0.03 -0.00 -0.00 -0.02 -0.01 -0.00 -0.02 0.01 -0.00 0.02 0.01 0.00 0.03 -0.01 -0.00 -0.05 -0.02 -0.00 -0.05 0.01 0.00 0.02 0.01 0.00 0.03 -0.01 -0.00 -0.03 -0.01 -0.00 -0.03 -0.01 -0.01 -0.03 0.02 0.01 0.05 0.03 0.01 0.08 0.00 -0.00 0.02 -0.00 0.00 -0.00 -0.00 -0.00 -0.01 -0.00 0.00 -0.01 -0.01 -0.00 -0.03 -0.00 -0.00 0.01 -0.00 -0.00 0.00 0.01 -0.00 0.02 0.00 -0.00 0.01 -0.00 -0.00 0.00 0.04 0.01 0.01 0.03 -0.12 0.43 -0.31 -0.02 -0.25 0.42 0.17 -0.15 0.00 0.03 0.03 -0.03 -0.15 -0.21 0.05 -0.10 0.34 -0.01 0.36 0.02 -0.03 -0.03 -0.05 -0.06 -0.00 -0.12 -0.03 0.01 -0.06 -0.05 -0.11 -0.05 -0.01 0.00 -0.01 0.00 0.00 0.01 0.00 0.00 0.01 0.00 0.00 0.01 -0.01 -0.00 -0.04 -0.01 -0.00 -0.03 0.00 0.00 0.02 -0.01 0.00 -0.02 0.01 0.00 0.02 0.01 -0.00 0.01 -0.01 -0.00 -0.03 -0.01 0.00 -0.02 0.02 0.00 0.06 0.01 -0.00 0.03 -0.00 -0.00 -0.01 -0.00 -0.00 -0.01 0.01 0.00 0.01 0.00 0.00 0.01 0.01 -0.00 0.02 -0.01 -0.00 -0.04 -0.00 -0.00 -0.02 0.00 0.00 0.02 -0.00 -0.00 -0.01 -0.00 -0.00 -0.00 -0.01 -0.00 -0.03 -0.00 -0.00 -0.01 0.01 0.00 0.02 0.00 0.00 0.01 0.00 0.00 0.01 -0.00 0.00 0.01 -0.00 0.00 0.00 -0.02 0.02 -0.06 -0.02 -0.05 0.06 -0.15 -0.02 -0.19 0.09 0.15 -0.12 -0.00 -0.01 0.05 0.06 0.11 0.24 0.01 0.07 -0.12 -0.07 -0.22 0.10 0.03 -0.02 -0.01 -0.35 0.02 -0.31 0.04 0.21 0.40 0.40 -0.32 -0.14 -0.01 -0.04 0.01 -0.02 -0.18 0.02 0.00 0.03 -0.00 0.06 -0.01 -0.03 -0.07 0.00 0.03 -0.08 -0.05 0.03 0.06 -0.06 -0.02 0.01 0.05 -0.00 0.10 -0.01 -0.04 0.09 -0.10 -0.03 0.01 -0.12 0.01 0.01 0.16 -0.01 0.17 0.02 -0.07 0.14 -0.14 -0.04 -0.10 -0.06 0.04 -0.09 0.01 0.04 -0.01 0.05 -0.00 -0.03 -0.11 0.01 0.00 0.14 -0.02 -0.15 -0.09 0.06 -0.15 0.05 0.06 0.03 0.29 -0.03 -0.10 -0.01 0.03 0.11 -0.04 -0.03 -0.22 -0.14 0.08 0.22 -0.18 -0.05 0.18 0.17 -0.06 0.31 0.20 -0.10 -0.13 0.20 0.02 -0.25 0.26 0.05 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.01 0.01 0.00 0.01 -0.01 -0.01 0.01 0.00 0.00 0.00 -0.00 -0.01 -0.01 0.00 -0.00 0.01 0.00 0.01 -0.00 0.00 -0.00 -0.00 -0.01 -0.00 -0.01 0.00 0.01 0.01 0.01 -0.01 -0.01 0.26 -0.03 -0.09 0.27 -0.04 -0.08 -0.01 0.00 0.01 0.16 -0.06 -0.05 0.16 0.02 -0.06 0.13 0.10 -0.05 0.12 -0.13 -0.03 0.03 -0.05 -0.01 -0.08 0.03 0.03 -0.07 0.14 0.02 0.05 0.18 -0.03 0.02 -0.18 0.00 -0.17 -0.01 0.06 -0.14 0.20 0.04 -0.10 -0.13 0.05 -0.10 -0.01 0.04 0.03 0.05 -0.01 0.02 -0.20 0.01 0.05 0.18 -0.03 -0.18 -0.18 0.08 -0.18 0.05 0.07 -0.11 0.03 0.05 -0.19 0.01 0.04 -0.18 0.02 0.03 -0.19 0.01 0.02 -0.17 -0.01 0.01 -0.15 0.05 0.06 -0.16 0.05 0.05 -0.17 0.02 0.07 -0.20 0.02 0.07 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.01 0.00 -0.01 -0.00 0.00 0.00 0.01 -0.01 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.01 0.00 0.00 0.01 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.01 -0.00 -0.00 -0.01 0.00 0.00 0.01 0.00 0.00 0.01 0.00 0.00 0.01 0.00 0.00 0.01 0.09 0.02 0.24 -0.06 0.07 -0.05 -0.06 -0.03 -0.23 -0.05 -0.05 -0.20 -0.23 0.37 -0.06 0.05 -0.01 -0.09 -0.11 -0.02 -0.20 -0.11 -0.01 -0.20 0.37 -0.05 -0.25 -0.06 -0.07 -0.04 -0.05 0.01 -0.20 -0.06 -0.01 -0.23 -0.28 -0.34 0.01 -0.00 -0.01 0.00 0.03 0.39 -0.04 0.00 0.01 -0.00 -0.15 -0.09 0.06 0.14 -0.12 -0.04 0.11 -0.01 -0.04 -0.11 0.02 0.04 0.05 -0.20 -0.00 -0.05 -0.16 0.02 -0.03 -0.03 0.01 0.08 0.02 -0.02 0.04 -0.32 0.01 -0.13 -0.19 0.04 -0.11 0.04 0.03 0.03 -0.03 -0.01 0.02 -0.15 0.01 -0.07 -0.18 0.04 -0.07 0.05 0.02 -0.09 -0.29 0.05 0.12 0.02 -0.04 0.10 -0.21 -0.01 0.01 0.17 -0.02 -0.07 -0.00 0.02 0.06 -0.02 -0.02 -0.14 -0.08 0.05 0.13 -0.11 -0.03 0.10 0.11 -0.04 0.19 0.14 -0.06 -0.08 0.13 0.01 -0.17 0.18 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.01 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.06 0.00 -0.03 -0.03 0.01 0.04 0.02 0.01 0.16 -0.09 -0.13 -0.02 -0.06 0.13 -0.05 -0.02 0.12 0.04 -0.04 -0.10 0.06 0.01 0.21 -0.06 0.05 0.24 0.04 0.02 0.20 -0.04 -0.05 0.16 -0.04 0.00 0.28 -0.09 0.07 0.24 0.13 0.05 0.16 -0.10 -0.01 -0.21 0.00 0.02 -0.24 0.09 -0.02 -0.22 -0.01 -0.08 -0.15 -0.00 -0.04 -0.30 -0.03 0.03 -0.18 -0.07 0.04 -0.23 0.17 0.03 -0.00 -0.04 0.09 -0.00 0.01 0.09 -0.01 0.01 0.09 -0.01 0.05 0.10 0.00 0.05 0.06 -0.02 -0.07 0.11 -0.00 -0.07 0.06 -0.00 -0.07 0.10 -0.02 -0.07 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.01 -0.01 0.01 0.00 0.01 -0.01 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.01 -0.00 0.01 -0.00 -0.01 -0.01 -0.01 0.01 0.00 -0.02 -0.01 -0.13 0.04 0.00 0.07 0.14 0.03 0.40 -0.02 0.03 -0.14 -0.03 -0.05 -0.13 0.05 -0.03 0.13 0.06 0.05 0.12 -0.03 -0.08 -0.06 0.05 -0.08 0.16 -0.03 -0.07 -0.07 -0.00 -0.06 -0.07 -0.05 -0.10 -0.11 0.11 -0.07 0.34 -0.10 -0.07 -0.24 -0.02 0.06 -0.09 0.06 0.10 0.14 -0.02 0.07 -0.08 0.00 0.04 -0.08 -0.03 0.09 -0.13 -0.10 0.03 -0.24 0.12 0.12 0.32 -0.03 -0.00 -0.05 -0.02 0.01 0.08 -0.02 0.01 0.08 0.01 0.02 0.17 0.01 0.01 0.17 -0.06 -0.00 -0.11 -0.07 -0.01 -0.06 -0.06 -0.01 -0.11 -0.07 0.00 -0.06 0.00 0.00 0.01 -0.00 0.01 -0.00 0.00 0.02 -0.04 0.03 -0.00 0.00 -0.03 0.01 0.01 -0.00 -0.00 -0.01 -0.01 0.00 -0.01 -0.01 0.00 -0.02 0.02 -0.00 -0.02 -0.00 -0.01 -0.00 0.03 -0.00 0.01 -0.00 -0.03 -0.04 -0.04 -0.01 0.01 0.02 0.20 -0.02 0.03 0.44 -0.04 -0.01 -0.12 0.01 0.13 0.10 -0.05 -0.11 0.12 0.04 -0.17 -0.14 0.07 0.15 -0.18 -0.04 -0.15 0.14 0.04 -0.09 0.06 0.03 -0.10 -0.17 0.04 -0.17 -0.20 0.06 -0.15 0.12 0.03 0.06 0.12 -0.02 -0.01 -0.25 0.02 0.08 -0.19 -0.01 0.09 0.03 -0.04 0.17 0.10 -0.07 0.14 -0.23 -0.02 0.17 0.09 -0.06 -0.02 -0.25 0.04 -0.04 0.13 -0.00 -0.00 -0.00 0.00 -0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.01 0.00 -0.01 -0.01 0.00 0.00 -0.01 0.00 0.01 -0.02 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.01 0.01 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.01 -0.00 -0.01 0.01 0.00 0.01 0.01 -0.00 0.00 0.01 -0.00 -0.00 -0.00 0.00 -0.01 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.07 -0.01 -0.19 0.02 0.01 0.07 -0.00 -0.00 -0.01 -0.06 -0.02 -0.16 -0.06 -0.01 -0.17 -0.01 0.00 -0.02 -0.01 -0.01 -0.02 0.07 0.01 0.18 -0.02 0.01 -0.07 -0.04 0.00 -0.11 0.07 0.01 0.20 0.17 0.03 0.48 -0.03 0.00 -0.09 -0.08 -0.00 -0.24 -0.04 -0.02 -0.11 -0.02 -0.02 -0.07 0.07 0.01 0.18 0.07 0.02 0.20 0.17 0.04 0.48 -0.08 -0.03 -0.24 -0.03 -0.02 -0.08 -0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.01 -0.00 -0.00 -0.01 0.02 0.00 0.06 -0.00 -0.00 -0.01 0.02 0.01 0.06 -0.01 0.00 0.00 0.01 0.01 -0.00 0.01 0.02 -0.01 0.02 -0.00 -0.01 0.01 0.01 -0.00 -0.01 0.00 0.01 -0.00 0.00 0.01 -0.00 0.00 0.01 -0.01 0.00 0.01 0.00 -0.01 -0.00 0.02 -0.00 -0.01 0.00 -0.02 -0.00 0.01 -0.01 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.01 -0.00 -0.00 -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 -0.00 0.01 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.02 -0.11 0.02 0.14 -0.06 -0.04 0.15 0.18 -0.08 0.33 -0.16 -0.05 0.16 -0.08 -0.05 -0.00 0.18 -0.01 -0.26 0.42 0.13 0.29 0.35 -0.19 -0.00 0.19 -0.01 -0.12 -0.06 0.05 -0.26 -0.10 0.06 -0.11 0.10 0.03 -0.15 -0.08 0.05 -0.00 -0.00 -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.01 0.00 0.00 0.01 0.00 -0.00 0.00 -0.00 -0.00 -0.01 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.00 -0.00 -0.01 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.00 0.01 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.11 -0.03 -0.04 -0.09 -0.13 0.04 -0.11 -0.42 0.14 -0.35 0.04 0.09 -0.09 -0.15 0.05 0.13 0.01 -0.05 0.07 0.04 -0.05 0.14 0.03 -0.09 0.16 0.00 -0.07 -0.10 0.14 0.03 -0.42 0.01 0.11 -0.07 0.49 0.06 -0.10 0.16 0.03 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.06 -0.02 -0.17 0.06 0.01 0.17 0.06 0.01 0.18 -0.06 -0.02 -0.18 -0.06 -0.01 -0.16 0.04 0.00 0.12 0.01 0.00 0.01 -0.05 -0.01 -0.15 -0.19 -0.03 -0.54 0.04 0.00 0.11 -0.03 -0.00 -0.09 -0.01 -0.00 -0.01 -0.04 -0.01 -0.12 0.06 0.02 0.16 0.05 0.02 0.15 0.19 0.05 0.54 0.03 0.01 0.09 -0.04 -0.01 -0.11 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.01 -0.02 -0.00 -0.07 -0.00 0.00 -0.01 0.02 0.01 0.07 -0.00 -0.00 0.00 0.01 -0.00 0.00 0.01 0.00 0.01 0.01 -0.01 -0.00 0.01 -0.00 -0.00 0.00 0.01 -0.00 -0.01 0.01 -0.01 0.01 0.01 0.01 0.00 0.03 -0.00 -0.01 -0.00 0.00 -0.01 -0.00 0.00 -0.01 0.00 -0.01 -0.01 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.06 -0.02 -0.18 0.06 0.01 0.18 -0.05 -0.01 -0.13 0.05 0.01 0.13 0.02 0.00 0.05 -0.05 -0.01 -0.14 0.05 0.01 0.16 -0.04 -0.00 -0.11 -0.00 0.00 -0.00 -0.11 -0.01 -0.32 0.16 0.02 0.48 -0.06 -0.02 -0.16 0.05 0.02 0.14 -0.02 -0.00 -0.05 0.04 0.01 0.11 0.00 0.00 0.00 -0.17 -0.05 -0.48 0.11 0.03 0.32 -0.00 -0.00 0.00 -0.00 -0.00 -0.01 0.00 0.00 0.01 -0.00 -0.00 -0.01 0.00 0.00 0.01 0.00 -0.00 0.01 -0.01 -0.00 -0.02 -0.00 -0.00 -0.00 0.01 -0.00 0.02 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.01 0.00 0.00 0.00 -0.01 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.01 0.01 -0.00 -0.00 0.14 -0.01 0.00 0.14 -0.02 -0.07 0.04 0.03 0.29 -0.03 -0.06 -0.00 -0.02 0.06 -0.01 -0.10 -0.01 -0.12 -0.10 0.00 -0.12 -0.04 0.07 0.10 -0.05 0.01 -0.12 0.02 -0.07 0.11 -0.04 -0.06 -0.05 0.03 0.08 0.30 0.04 0.05 -0.15 0.15 -0.07 0.42 0.03 0.08 0.09 -0.05 -0.03 -0.12 -0.05 -0.04 0.11 -0.03 0.06 -0.06 0.02 -0.03 0.31 0.17 0.13 0.40 0.03 -0.08 -0.14 0.01 0.01 0.07 0.03 0.00 0.02 0.03 -0.00 0.02 0.03 -0.00 0.07 0.04 0.01 0.07 -0.01 -0.02 -0.08 0.02 -0.01 -0.05 -0.00 0.00 -0.08 0.02 -0.00 -0.05 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.22 -0.03 -0.11 0.27 -0.03 -0.07 -0.15 -0.01 -0.18 -0.05 -0.10 0.03 -0.03 0.11 0.01 -0.06 -0.01 0.13 -0.05 0.04 0.12 -0.14 0.11 -0.02 0.01 0.04 0.10 -0.05 -0.13 -0.07 -0.02 -0.11 0.07 -0.19 0.12 -0.17 0.17 0.11 0.05 -0.09 -0.17 -0.32 -0.03 0.12 -0.09 0.01 -0.03 0.11 -0.16 -0.10 -0.00 -0.00 0.12 0.04 -0.21 -0.12 -0.14 -0.06 0.12 -0.35 0.16 -0.13 0.07 -0.03 -0.00 -0.04 0.04 -0.00 -0.03 0.04 -0.01 -0.03 0.02 -0.02 -0.05 0.02 0.00 -0.06 0.04 -0.02 0.04 0.07 -0.01 0.01 0.04 0.02 0.04 0.07 0.00 0.01 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.01 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.01 0.00 -0.00 -0.00 0.01 -0.00 -0.00 0.00 0.00 -0.01 0.00 0.00 0.01 -0.00 0.01 -0.01 0.00 0.00 0.01 -0.00 0.01 0.00 0.00 -0.00 0.00 0.01 0.00 -0.01 0.00 0.00 0.01 -0.00 -0.00 -0.01 -0.00 -0.00 -0.01 -0.00 -0.01 0.01 0.00 -0.00 0.00 0.00 -0.00 0.06 0.02 0.25 -0.06 -0.02 -0.25 0.16 0.05 0.60 -0.16 -0.05 -0.60 0.05 0.02 0.19 0.01 0.01 0.03 -0.05 -0.02 -0.19 -0.01 0.00 -0.03 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.01 0.08 -0.01 -0.00 -0.02 0.00 0.01 0.16 -0.02 0.09 0.12 -0.04 -0.07 0.14 0.01 0.02 0.15 -0.02 -0.00 0.15 -0.01 -0.28 0.02 0.10 -0.01 -0.21 0.01 0.04 -0.15 -0.01 0.27 -0.01 -0.09 -0.28 0.07 0.10 0.22 -0.11 -0.07 -0.17 0.01 0.06 -0.06 -0.14 0.03 -0.02 -0.21 0.03 0.28 -0.04 -0.10 -0.26 0.04 0.08 0.28 0.01 -0.11 0.17 -0.02 -0.05 -0.23 -0.06 0.09 -0.00 -0.03 0.00 0.02 0.02 0.01 -0.02 0.02 -0.01 0.06 0.05 0.02 -0.05 0.05 -0.03 -0.02 -0.03 0.02 -0.04 -0.04 0.01 0.01 -0.03 -0.01 0.04 -0.04 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.06 0.01 0.02 -0.08 0.01 0.03 -0.16 0.01 0.03 -0.09 -0.08 0.04 -0.07 0.10 0.02 0.03 0.19 -0.02 0.00 -0.20 0.02 -0.25 0.01 0.09 0.01 -0.19 0.01 0.07 -0.01 -0.02 0.30 0.10 -0.10 -0.25 0.11 0.08 0.15 -0.13 -0.05 -0.17 0.18 0.04 0.07 -0.00 -0.03 0.04 0.19 -0.03 -0.25 0.05 0.08 0.28 -0.16 -0.08 -0.26 -0.06 0.09 -0.20 -0.14 0.07 0.16 0.10 -0.07 -0.05 0.00 0.01 0.04 0.00 -0.01 0.04 -0.01 -0.01 0.01 -0.03 0.01 0.02 0.03 0.00 0.02 -0.03 -0.00 0.09 -0.01 -0.04 0.03 0.03 -0.01 0.09 -0.01 -0.04 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.02 -0.24 0.02 0.02 0.20 -0.02 0.02 0.27 -0.03 0.17 -0.18 -0.04 -0.20 -0.15 0.07 -0.22 0.14 0.07 0.24 0.09 -0.09 -0.01 -0.07 0.01 0.14 -0.14 -0.04 0.15 0.12 -0.06 -0.11 0.04 0.04 0.01 0.27 -0.01 0.03 -0.19 -0.00 0.18 0.09 -0.06 -0.13 0.15 0.03 -0.16 -0.11 0.07 -0.00 -0.07 0.01 0.11 0.01 -0.04 0.03 0.26 -0.04 -0.16 0.13 0.04 -0.06 -0.18 0.04 -0.00 -0.03 0.00 0.02 0.00 -0.00 -0.02 0.01 0.00 0.06 0.04 -0.01 -0.05 0.05 0.01 -0.03 -0.05 0.01 -0.08 -0.07 0.03 0.02 -0.05 -0.00 0.06 -0.08 -0.02 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.05 0.01 0.16 -0.01 -0.00 -0.04 -0.03 -0.00 -0.06 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.03 -0.00 -0.08 -0.03 -0.01 -0.08 -0.01 -0.01 -0.06 0.02 -0.00 0.05 -0.02 0.00 -0.07 0.03 0.01 0.09 -0.00 -0.01 -0.02 0.04 0.00 0.15 -0.05 -0.00 -0.15 -0.02 -0.01 -0.06 0.02 0.01 0.05 -0.01 -0.00 -0.06 0.03 0.01 0.09 -0.00 0.00 -0.02 -0.05 -0.02 -0.15 0.04 0.02 0.14 0.08 0.03 0.31 -0.00 -0.00 -0.02 -0.00 -0.00 -0.02 0.14 0.04 0.54 0.14 0.05 0.54 -0.03 -0.01 -0.13 -0.03 -0.01 -0.14 -0.03 -0.01 -0.13 -0.03 -0.01 -0.14 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.01 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.07 0.02 0.21 -0.02 -0.00 -0.05 0.02 0.00 0.06 -0.01 -0.01 -0.03 -0.01 0.00 -0.03 -0.02 -0.00 -0.08 -0.02 -0.01 -0.08 -0.02 -0.00 -0.06 0.01 0.00 0.02 -0.02 -0.00 -0.06 0.03 0.00 0.07 0.05 0.01 0.14 0.10 0.01 0.30 -0.00 -0.00 0.00 -0.02 -0.00 -0.06 0.01 0.00 0.02 -0.02 -0.01 -0.05 0.03 0.01 0.07 0.05 0.02 0.14 -0.00 0.00 0.00 0.10 0.03 0.30 -0.02 -0.01 -0.10 0.01 0.00 0.06 0.01 0.01 0.06 -0.14 -0.04 -0.53 -0.14 -0.05 -0.53 0.00 0.00 0.01 0.03 0.01 0.14 0.00 -0.00 0.01 0.03 0.01 0.14 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.03 0.01 0.08 -0.01 -0.00 -0.02 0.02 0.00 0.06 -0.01 -0.00 -0.02 -0.01 0.00 -0.02 -0.00 -0.00 -0.01 -0.00 -0.00 -0.02 -0.01 0.00 -0.02 -0.01 0.00 -0.01 -0.01 -0.00 -0.02 0.01 -0.00 0.01 0.04 0.01 0.12 0.06 0.01 0.17 0.02 0.00 0.07 -0.01 0.00 -0.02 -0.01 -0.00 -0.01 -0.01 -0.00 -0.02 0.01 0.00 0.01 0.04 0.01 0.12 0.02 0.01 0.07 0.06 0.01 0.17 -0.04 -0.01 -0.16 -0.03 -0.01 -0.10 -0.03 -0.01 -0.10 0.15 0.05 0.60 0.15 0.05 0.60 0.02 0.01 0.09 0.02 0.01 0.10 0.02 0.01 0.09 0.02 0.01 0.10 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.11 0.01 0.02 -0.13 0.01 0.04 0.28 -0.03 -0.09 0.06 -0.12 -0.01 0.08 0.11 -0.03 0.18 -0.08 -0.06 0.19 0.04 -0.07 -0.08 0.14 0.02 -0.11 0.17 0.03 -0.12 -0.16 0.05 0.14 -0.06 -0.05 -0.10 -0.05 0.02 0.14 0.29 -0.08 -0.14 -0.14 0.05 -0.09 0.18 0.02 -0.13 -0.15 0.06 -0.10 -0.12 0.05 0.15 0.03 -0.06 -0.09 0.06 0.02 -0.12 0.17 0.02 0.10 -0.32 -0.02 0.13 -0.01 -0.00 -0.09 -0.00 0.03 -0.09 0.02 0.02 -0.01 0.08 0.00 -0.02 -0.08 0.02 -0.03 0.09 -0.01 -0.19 0.05 0.06 -0.05 -0.08 0.01 -0.19 -0.01 0.06 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.03 0.01 0.08 -0.03 -0.00 -0.08 0.06 0.01 0.17 -0.06 -0.02 -0.17 0.01 0.00 0.02 -0.04 -0.00 -0.10 0.01 0.00 0.04 -0.03 -0.00 -0.09 0.13 0.02 0.37 0.12 0.01 0.34 0.12 0.01 0.36 -0.01 -0.00 -0.04 0.04 0.01 0.10 -0.01 -0.00 -0.02 0.03 0.01 0.09 -0.13 -0.04 -0.37 -0.12 -0.04 -0.36 -0.12 -0.04 -0.34 0.00 -0.00 -0.00 -0.00 -0.00 -0.01 0.00 0.00 0.01 0.00 0.00 0.01 -0.00 -0.00 -0.01 0.00 0.00 0.00 -0.02 -0.00 -0.09 -0.00 -0.00 -0.00 0.02 0.01 0.09 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.03 -0.01 -0.09 -0.01 -0.00 -0.03 -0.01 -0.00 -0.03 0.04 0.01 0.12 0.04 0.01 0.11 -0.01 -0.00 -0.02 -0.03 -0.00 -0.08 -0.00 -0.00 -0.01 -0.01 -0.00 -0.03 0.11 0.02 0.32 0.16 0.02 0.48 0.10 0.01 0.29 -0.00 -0.00 -0.01 -0.03 -0.01 -0.08 -0.01 -0.00 -0.02 -0.01 -0.00 -0.03 0.11 0.03 0.32 0.10 0.03 0.29 0.17 0.05 0.47 0.02 0.00 0.06 0.00 0.00 0.01 0.00 0.00 0.01 -0.01 -0.00 -0.03 -0.01 -0.00 -0.03 -0.01 -0.00 -0.02 -0.02 -0.01 -0.08 -0.01 -0.00 -0.02 -0.02 -0.01 -0.08 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.03 -0.01 -0.10 0.03 0.01 0.10 -0.02 -0.00 -0.06 0.02 0.01 0.06 -0.03 -0.00 -0.07 -0.01 -0.00 -0.03 -0.03 -0.00 -0.07 0.02 0.00 0.05 0.05 0.01 0.16 0.20 0.02 0.58 0.07 0.01 0.20 0.03 0.01 0.07 0.01 0.00 0.02 0.03 0.01 0.07 -0.02 -0.01 -0.05 -0.05 -0.02 -0.15 -0.07 -0.02 -0.20 -0.20 -0.06 -0.57 0.00 0.00 0.00 0.00 0.00 0.02 -0.00 -0.00 -0.02 -0.01 -0.00 -0.04 0.01 0.00 0.04 -0.00 -0.00 -0.01 0.04 0.01 0.16 0.00 0.00 0.01 -0.04 -0.02 -0.16 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.01 0.00 0.02 -0.01 -0.00 -0.02 0.01 0.00 0.02 -0.01 -0.00 -0.02 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 0.00 0.01 -0.01 -0.00 -0.02 -0.01 -0.00 -0.02 -0.03 -0.00 -0.08 -0.00 0.00 -0.00 -0.00 -0.00 -0.01 -0.00 -0.00 -0.00 -0.00 -0.00 -0.01 0.01 0.00 0.02 0.01 0.00 0.02 0.00 -0.00 0.00 0.03 0.01 0.08 0.00 0.00 -0.00 0.03 0.01 0.11 -0.03 -0.01 -0.11 -0.12 -0.04 -0.46 0.12 0.03 0.46 -0.01 0.00 -0.03 0.12 0.03 0.49 0.01 0.00 0.03 -0.12 -0.05 -0.48 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.01 -0.00 0.00 0.00 -0.00 0.01 -0.00 -0.00 -0.01 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.01 -0.00 -0.00 -0.00 -0.01 -0.01 0.00 -0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.01 0.00 0.00 0.01 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.01 0.00 0.00 0.01 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.01 0.00 0.05 -0.00 -0.00 -0.00 0.01 0.01 0.05 -0.06 -0.01 -0.15 -0.09 0.23 0.06 -0.09 0.31 0.12 -0.10 0.30 0.13 -0.05 0.14 0.05 0.25 -0.02 -0.05 0.34 -0.03 -0.01 0.34 -0.02 -0.01 0.15 -0.01 -0.01 -0.12 -0.20 0.10 -0.14 -0.25 0.18 -0.13 -0.26 0.18 -0.06 -0.11 0.08 0.01 -0.01 -0.09 0.06 -0.00 0.00 0.20 -0.02 -0.06 -0.04 0.02 0.09 -0.05 0.00 0.09 -0.04 -0.01 -0.02 -0.04 0.01 -0.02 -0.10 0.01 0.02 0.05 -0.09 -0.02 0.06 0.08 -0.05 -0.06 0.03 0.03 -0.10 0.19 -0.01 0.09 -0.09 0.14 0.09 0.09 0.06 0.05 -0.09 -0.03 0.06 0.07 -0.04 -0.10 0.01 0.02 -0.06 -0.02 0.03 -0.12 -0.17 0.02 0.08 -0.09 0.07 0.11 0.10 0.12 0.17 -0.02 -0.03 -0.06 -0.01 0.01 -0.06 0.02 0.01 0.13 0.18 -0.00 0.10 -0.20 0.01 -0.01 0.15 -0.03 -0.16 0.11 0.44 -0.03 -0.15 -0.00 -0.17 0.00 0.44 0.00 0.00 0.00 0.00 -0.01 -0.00 0.00 -0.01 -0.01 -0.00 -0.01 -0.00 -0.00 0.00 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 0.00 0.01 -0.00 0.00 0.01 -0.01 0.01 0.01 -0.01 -0.00 -0.00 0.00 0.09 0.02 0.22 0.00 -0.01 -0.06 0.07 -0.01 -0.07 -0.09 -0.01 -0.17 -0.09 -0.01 -0.17 0.02 -0.00 0.10 0.02 0.02 0.10 -0.02 0.00 0.05 0.03 -0.03 0.01 0.05 0.03 0.06 -0.04 0.01 -0.04 -0.00 0.08 0.10 -0.13 -0.06 -0.44 -0.04 0.03 -0.20 0.04 -0.03 0.07 0.03 0.03 0.01 -0.02 0.01 0.05 -0.04 -0.01 -0.04 -0.01 -0.05 0.11 -0.05 -0.06 -0.20 -0.13 -0.01 -0.44 0.06 -0.01 -0.01 -0.02 -0.00 0.01 -0.02 0.01 0.01 0.04 0.07 -0.03 0.03 -0.08 -0.03 0.00 0.06 0.01 -0.18 0.01 -0.29 -0.00 -0.06 0.02 -0.18 -0.05 -0.29 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.01 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.01 -0.00 0.00 0.01 -0.00 -0.00 0.01 0.00 -0.00 0.01 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.01 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.01 0.00 -0.00 0.01 -0.00 -0.00 -0.01 0.00 0.00 0.01 -0.00 -0.00 -0.01 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.02 0.00 0.00 0.01 0.01 0.00 0.03 -0.00 -0.00 -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.01 -0.00 -0.02 -0.01 -0.00 -0.01 0.01 -0.00 0.01 -0.01 -0.00 -0.04 0.00 -0.00 0.00 0.01 0.01 0.06 -0.01 0.00 -0.06 -0.11 -0.02 -0.44 0.12 0.05 0.44 0.02 -0.00 0.04 -0.12 -0.04 -0.51 -0.02 -0.01 -0.04 0.12 0.05 0.52 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.01 -0.01 -0.01 0.01 0.00 -0.00 -0.00 0.00 -0.01 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.01 -0.00 0.00 0.00 0.01 0.01 -0.00 0.01 0.00 0.04 -0.01 -0.00 -0.01 -0.04 0.00 -0.02 -0.01 -0.01 -0.04 -0.01 -0.00 -0.04 0.01 0.00 0.03 0.01 0.00 0.03 0.02 -0.00 0.01 -0.00 0.01 0.01 -0.00 -0.01 0.02 -0.00 -0.00 -0.03 0.01 -0.02 0.01 -0.04 0.01 -0.10 -0.01 -0.01 -0.01 -0.00 0.01 0.01 -0.01 -0.01 0.01 0.02 0.00 0.01 -0.00 -0.00 -0.03 0.02 0.02 0.00 -0.01 0.01 -0.01 -0.04 -0.02 -0.10 -0.01 0.00 0.03 0.01 -0.00 -0.01 0.01 -0.00 -0.01 -0.00 -0.02 0.04 -0.00 0.03 0.03 -0.01 -0.02 -0.04 0.20 0.03 0.66 -0.01 0.01 -0.04 0.20 0.07 0.65 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.01 -0.01 -0.00 -0.01 -0.01 -0.01 0.01 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.01 0.00 0.01 -0.01 -0.01 -0.00 0.00 0.00 0.04 -0.00 -0.00 -0.02 0.00 0.01 0.17 -0.02 -0.03 0.02 0.01 0.03 0.01 -0.01 -0.01 0.05 0.01 0.02 0.05 -0.02 0.07 -0.02 -0.02 -0.01 0.01 0.00 -0.04 -0.08 0.02 -0.02 -0.04 0.01 0.07 -0.12 -0.02 0.01 0.02 -0.01 -0.01 -0.10 0.01 0.03 -0.08 -0.00 0.01 0.01 -0.00 -0.08 -0.00 0.03 0.02 -0.04 0.00 -0.09 -0.10 0.04 -0.00 -0.10 0.01 -0.00 0.02 0.00 -0.01 -0.11 0.01 -0.22 0.28 0.03 0.26 0.24 -0.08 -0.20 0.32 0.08 0.24 0.27 -0.14 0.15 -0.21 -0.03 0.14 -0.25 0.10 -0.18 -0.17 0.07 -0.17 -0.23 -0.03 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.02 0.28 -0.03 -0.01 -0.09 0.01 0.03 0.35 -0.04 -0.07 0.12 0.01 0.09 0.10 -0.03 -0.05 0.12 0.01 0.06 0.11 -0.04 0.17 -0.08 -0.05 0.04 -0.10 -0.01 -0.07 -0.13 0.03 -0.13 -0.07 0.05 0.16 -0.31 -0.05 0.01 -0.12 0.01 -0.04 -0.17 0.01 0.06 -0.14 -0.01 -0.05 -0.08 0.03 -0.18 -0.04 0.07 0.11 -0.09 -0.03 -0.21 -0.25 0.10 0.02 -0.18 0.02 -0.03 -0.12 0.02 0.00 0.05 -0.01 0.12 -0.11 -0.02 -0.14 -0.08 0.04 0.22 -0.02 -0.06 -0.22 0.03 0.06 -0.06 0.03 0.02 -0.00 0.05 -0.03 0.07 0.02 -0.02 0.01 0.06 0.02 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.01 0.00 0.00 0.00 -0.00 0.01 -0.00 -0.00 -0.01 -0.00 0.01 -0.00 -0.01 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.01 0.00 0.02 0.33 -0.03 -0.01 -0.07 0.01 -0.02 -0.25 0.02 -0.01 0.13 -0.01 0.03 0.13 -0.01 0.01 -0.08 -0.00 -0.02 -0.08 0.02 -0.07 -0.05 0.03 0.09 -0.25 -0.02 0.10 0.17 -0.04 -0.15 0.06 0.05 -0.06 0.04 0.02 -0.14 -0.35 0.06 0.06 0.21 -0.02 -0.07 0.19 0.01 -0.12 -0.22 0.06 0.06 -0.07 -0.01 0.16 0.03 -0.06 0.06 0.03 -0.03 -0.03 0.22 -0.02 0.09 -0.37 0.01 -0.00 -0.03 0.00 -0.07 0.05 0.01 0.08 0.04 -0.02 -0.15 -0.02 0.04 0.14 -0.05 -0.03 0.03 -0.01 -0.01 -0.02 -0.03 0.01 -0.03 -0.00 0.01 0.01 -0.03 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.01 -0.00 -0.02 0.00 0.00 0.01 -0.00 -0.00 -0.01 0.01 0.00 0.02 -0.01 -0.00 -0.03 -0.01 -0.00 -0.03 0.03 0.00 0.09 -0.00 -0.00 -0.01 0.07 0.01 0.20 0.04 0.00 0.13 -0.16 -0.02 -0.47 -0.04 -0.01 -0.13 0.02 0.01 0.05 0.02 0.00 0.05 0.00 0.00 0.01 -0.10 -0.03 -0.28 0.24 0.08 0.67 -0.07 -0.02 -0.20 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.01 -0.00 -0.00 -0.01 -0.00 -0.00 -0.00 0.01 0.00 0.03 0.00 0.00 0.00 -0.01 -0.00 -0.04 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.01 0.00 0.02 -0.00 -0.00 -0.00 -0.00 -0.00 -0.01 -0.01 -0.00 -0.02 -0.01 -0.00 -0.03 0.01 0.00 0.02 0.01 0.00 0.02 0.01 0.00 0.04 0.02 0.00 0.06 -0.04 -0.01 -0.13 0.00 0.00 0.01 -0.09 -0.01 -0.25 -0.08 -0.01 -0.23 0.23 0.03 0.68 -0.03 -0.01 -0.09 0.01 0.00 0.04 0.01 0.00 0.03 0.00 0.00 0.01 -0.06 -0.02 -0.16 0.16 0.05 0.47 -0.06 -0.02 -0.17 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.01 -0.00 -0.04 0.00 0.00 0.00 -0.01 -0.00 -0.03 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.16 -0.02 -0.05 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.05 -0.05 -0.01 0.05 0.04 -0.02 -0.07 0.02 0.02 0.02 -0.03 -0.00 0.03 0.04 -0.01 -0.04 0.01 0.01 -0.06 0.10 0.04 0.06 -0.01 -0.03 0.05 0.03 -0.02 0.03 -0.05 -0.00 0.02 0.02 -0.01 -0.08 -0.00 0.02 -0.05 -0.00 0.02 -0.08 -0.08 0.05 0.05 -0.04 -0.02 0.06 -0.01 -0.02 -0.01 0.00 0.01 -0.01 -0.02 0.00 -0.00 0.02 -0.00 -0.43 -0.45 0.14 -0.35 0.52 0.05 -0.02 -0.15 0.02 0.06 -0.13 0.01 0.00 0.15 -0.01 0.08 0.12 -0.02 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.01 0.00 -0.01 0.01 -0.00 -0.01 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 0.00 -0.00 0.00 -0.01 -0.00 0.00 0.00 0.01 -0.00 -0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.01 -0.00 -0.02 0.01 0.00 0.02 0.00 0.00 0.01 -0.00 -0.00 -0.01 -0.03 -0.00 -0.10 0.02 0.00 0.07 -0.01 -0.00 -0.02 -0.00 -0.00 -0.00 0.19 0.03 0.55 -0.12 -0.02 -0.36 0.03 0.00 0.11 0.01 0.00 0.02 -0.02 -0.01 -0.07 0.03 0.01 0.09 0.00 -0.00 0.00 -0.19 -0.05 -0.53 -0.04 -0.01 -0.10 0.12 0.04 0.34 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.01 -0.00 -0.04 0.00 0.00 0.01 -0.00 0.00 -0.00 0.01 0.00 0.04 0.01 0.00 0.04 0.00 0.00 0.00 0.00 -0.00 0.00 -0.03 -0.00 -0.10 0.02 0.00 0.06 -0.01 -0.00 -0.01 -0.00 -0.00 -0.00 0.19 0.03 0.54 -0.11 -0.01 -0.32 0.03 0.00 0.09 -0.01 -0.00 -0.01 0.02 0.01 0.07 -0.03 -0.01 -0.10 -0.00 0.00 -0.00 0.20 0.06 0.57 0.03 0.01 0.09 -0.12 -0.04 -0.34 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.01 0.01 -0.00 0.00 -0.01 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.01 0.00 0.00 -0.01 0.00 0.00 0.02 -0.02 -0.01 0.01 -0.04 0.00 0.01 0.03 -0.01 0.04 0.04 -0.02 0.02 -0.06 -0.00 0.07 0.04 -0.02 0.09 -0.11 -0.03 -0.13 -0.06 0.05 -0.06 0.05 0.02 0.10 0.48 -0.07 0.30 -0.03 -0.10 -0.34 0.09 0.11 -0.09 0.08 0.02 0.09 0.06 -0.04 0.05 -0.03 -0.01 -0.06 -0.02 0.02 0.03 -0.27 0.01 -0.25 0.00 0.09 0.28 -0.05 -0.09 -0.02 0.01 0.01 0.01 0.01 -0.00 -0.04 -0.00 0.01 0.14 0.14 -0.04 -0.12 0.10 0.02 0.03 -0.02 -0.01 0.29 0.05 -0.07 -0.02 -0.01 0.01 -0.03 -0.01 0.01 -0.00 0.00 0.00 -0.01 -0.01 0.00 -0.01 0.06 0.01 0.03 -0.05 -0.02 0.03 0.01 -0.01 0.01 0.01 0.00 0.04 -0.02 -0.01 -0.04 -0.01 0.01 0.01 -0.02 -0.00 0.00 -0.00 -0.00 -0.02 -0.02 0.02 0.01 0.03 -0.00 -0.01 0.02 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.01 0.00 -0.00 0.00 0.00 -0.01 -0.00 0.00 -0.01 0.01 0.00 0.01 0.01 -0.00 0.01 -0.00 -0.00 -0.01 -0.04 0.01 -0.04 -0.00 0.01 0.03 -0.01 -0.01 0.01 -0.01 -0.00 -0.01 -0.01 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.03 -0.00 0.02 0.00 -0.01 -0.02 0.00 0.01 0.00 0.00 -0.00 0.01 -0.00 -0.00 -0.01 0.00 0.00 0.05 0.04 -0.02 -0.04 0.05 0.01 0.01 -0.01 -0.00 0.04 0.00 -0.01 -0.01 -0.00 0.00 -0.06 0.02 0.01 0.00 -0.00 0.00 -0.07 -0.03 0.03 -0.04 0.37 0.05 0.20 -0.30 -0.14 0.16 0.10 -0.07 0.01 0.08 -0.01 0.34 -0.12 -0.05 -0.36 -0.06 0.07 -0.01 -0.19 0.02 0.06 -0.05 -0.02 -0.24 -0.23 0.19 0.09 0.34 -0.12 -0.14 0.13 0.04 -0.00 -0.01 0.00 -0.00 -0.00 0.00 0.01 0.02 -0.00 0.00 -0.00 -0.00 0.01 0.01 -0.00 0.00 0.03 -0.00 0.01 0.01 -0.00 0.02 0.00 -0.01 0.02 -0.02 -0.01 -0.04 -0.02 0.01 -0.02 0.00 0.01 0.02 0.03 -0.01 0.11 0.02 -0.04 -0.07 0.00 0.03 -0.01 0.01 0.00 0.02 0.02 -0.01 0.01 -0.01 -0.00 -0.01 -0.01 0.00 -0.00 -0.12 0.01 -0.06 -0.02 0.02 0.02 0.02 -0.01 -0.01 -0.03 0.00 -0.07 0.01 0.02 0.07 -0.01 -0.02 -0.39 -0.30 0.12 0.34 -0.38 -0.05 -0.06 0.04 0.01 -0.41 -0.05 0.09 0.07 0.03 -0.02 0.42 -0.14 -0.08 -0.00 -0.00 0.00 -0.01 -0.01 0.00 -0.01 0.07 0.02 0.04 -0.05 -0.02 0.03 0.01 -0.01 0.00 0.01 -0.00 0.06 -0.02 -0.01 -0.06 -0.01 0.01 0.00 -0.03 0.00 0.01 -0.01 -0.00 -0.04 -0.03 0.03 0.02 0.06 -0.03 -0.02 0.01 0.01 0.00 -0.04 0.00 0.00 0.01 -0.00 -0.01 -0.05 0.01 0.00 -0.00 -0.00 -0.02 -0.02 0.01 0.03 0.00 -0.01 -0.04 0.03 0.01 0.05 0.04 -0.02 0.04 -0.06 -0.01 -0.09 -0.04 0.03 -0.01 0.04 0.00 0.07 0.50 -0.06 0.17 -0.01 -0.06 -0.27 0.10 0.09 0.11 -0.08 -0.03 -0.09 -0.07 0.04 -0.05 0.06 0.01 0.04 0.04 -0.02 -0.01 0.54 -0.05 0.36 0.04 -0.13 -0.29 0.06 0.10 0.00 -0.01 -0.00 -0.01 0.00 0.00 0.01 0.00 -0.00 -0.04 -0.03 0.01 0.03 -0.02 -0.01 -0.00 0.01 0.00 0.00 0.01 -0.00 0.00 0.01 -0.00 -0.04 0.03 0.01 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.01 0.02 0.00 -0.00 -0.00 -0.00 -0.01 0.00 0.00 0.01 0.00 0.00 -0.01 0.01 0.00 0.00 -0.00 -0.00 -0.01 -0.01 0.01 0.01 0.02 -0.01 -0.00 0.01 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.02 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.02 0.00 -0.01 -0.00 0.01 0.01 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.01 0.00 0.03 0.00 0.00 0.00 -0.01 -0.00 -0.03 -0.01 -0.10 0.01 -0.06 0.07 0.09 -0.05 0.23 -0.04 0.05 -0.17 -0.13 -0.04 0.35 0.03 -0.01 -0.11 0.01 -0.44 0.14 0.06 0.46 0.06 -0.07 0.01 0.21 -0.02 0.07 0.04 -0.10 -0.08 -0.13 0.16 0.08 0.22 -0.01 0.09 0.32 -0.09 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.01 -0.03 0.00 0.01 0.01 -0.00 0.01 -0.00 -0.00 0.01 -0.01 -0.00 -0.00 -0.00 0.00 -0.01 0.01 0.00 -0.00 0.00 -0.00 -0.00 0.05 -0.00 0.02 0.00 -0.01 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.01 0.00 -0.00 -0.00 -0.00 0.01 0.00 0.02 -0.00 0.00 -0.00 0.00 0.00 0.02 -0.10 0.01 0.03 -0.07 -0.10 -0.01 -0.04 0.37 0.12 0.22 -0.33 -0.11 0.22 -0.09 -0.10 0.14 -0.01 0.04 -0.00 -0.03 -0.08 0.01 0.01 -0.09 0.36 -0.03 -0.09 -0.05 0.10 -0.03 0.27 0.26 -0.17 -0.09 -0.33 0.19 0.23 0.04 -0.11 0.02 0.01 -0.01 0.03 -0.00 -0.01 -0.01 0.01 0.00 -0.04 0.06 0.01 -0.06 -0.05 0.02 -0.06 -0.02 0.02 -0.04 0.01 0.01 0.08 0.02 -0.03 -0.05 0.01 0.02 -0.03 -0.02 0.01 0.09 0.00 -0.03 0.10 0.41 -0.06 -0.35 -0.13 0.13 -0.11 0.05 0.04 -0.03 0.03 0.01 -0.03 0.00 0.01 0.05 -0.04 -0.02 0.06 -0.02 -0.02 0.03 -0.37 0.03 -0.14 -0.02 0.05 -0.15 0.09 0.04 0.07 -0.00 -0.02 0.03 -0.05 -0.00 0.04 0.05 -0.01 -0.19 -0.29 0.07 -0.15 0.32 0.01 -0.01 0.03 0.00 -0.26 -0.04 0.06 -0.02 -0.02 0.01 -0.23 0.08 0.05 -0.01 0.00 0.00 -0.00 -0.01 0.00 -0.00 0.02 -0.00 0.01 -0.03 -0.01 0.01 0.01 -0.00 0.01 -0.00 -0.00 0.01 0.00 0.00 0.01 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.01 0.00 0.02 0.02 -0.02 -0.00 -0.02 0.00 0.01 -0.01 -0.00 -0.00 -0.07 0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.05 0.02 0.02 0.04 -0.00 -0.02 0.05 0.03 -0.02 -0.06 0.04 0.02 -0.07 -0.01 0.02 0.06 0.01 -0.02 -0.01 -0.00 0.00 -0.08 0.01 0.02 -0.09 -0.26 0.04 0.50 0.21 -0.18 0.03 -0.03 -0.01 -0.01 0.01 0.00 -0.06 0.03 0.02 0.09 -0.04 -0.03 0.09 -0.01 -0.03 0.07 -0.35 0.01 -0.08 -0.03 0.03 -0.49 0.33 0.14 0.01 -0.00 -0.00 0.01 -0.01 -0.00 0.01 0.01 -0.00 -0.01 -0.04 0.01 -0.06 0.10 0.01 0.00 0.01 -0.00 0.00 0.01 -0.00 -0.01 -0.01 0.00 -0.11 0.04 0.02 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.01 0.00 -0.01 -0.01 -0.01 0.02 0.00 0.00 0.00 -0.00 0.01 0.00 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.02 -0.00 -0.01 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.01 -0.00 -0.00 0.00 -0.03 0.00 -0.01 -0.00 0.00 -0.02 0.01 0.01 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.01 0.00 0.01 0.00 0.00 -0.00 0.01 -0.00 0.01 0.05 -0.01 -0.02 -0.00 0.04 -0.05 -0.01 0.01 0.15 -0.03 0.23 0.16 0.07 -0.26 -0.02 -0.03 0.01 0.12 -0.35 -0.06 -0.18 -0.34 0.08 -0.20 0.52 -0.05 -0.16 -0.01 -0.05 -0.05 -0.06 -0.19 0.20 -0.01 0.02 0.15 0.11 0.24 -0.07 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.01 -0.01 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.01 -0.01 0.00 0.01 -0.01 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.01 0.00 0.00 0.00 0.00 -0.00 -0.01 0.00 0.05 -0.01 0.08 -0.05 0.07 0.07 -0.28 -0.29 -0.09 -0.19 -0.22 -0.20 0.41 0.07 0.00 0.04 -0.00 0.13 -0.04 -0.03 -0.13 -0.01 0.04 -0.01 -0.04 0.01 -0.08 -0.05 -0.06 0.06 -0.15 0.25 -0.10 -0.21 0.34 0.25 0.35 -0.14 -0.01 0.00 0.00 -0.02 0.00 0.01 -0.06 0.00 0.02 0.02 -0.05 -0.00 0.02 0.04 -0.01 -0.01 0.04 0.00 -0.00 -0.05 0.01 0.00 -0.03 -0.00 0.03 -0.00 -0.01 -0.02 -0.01 0.01 -0.03 0.00 0.01 -0.01 -0.32 0.02 0.25 0.09 -0.09 -0.04 0.00 0.01 -0.01 0.01 0.00 0.04 -0.01 -0.01 -0.01 0.03 -0.00 -0.04 0.01 0.01 0.02 0.37 -0.05 -0.00 0.02 -0.00 0.28 -0.18 -0.08 0.04 -0.00 -0.01 0.08 -0.07 -0.01 0.09 0.06 -0.03 -0.13 -0.31 0.06 -0.10 0.34 -0.00 -0.03 0.06 0.00 -0.35 -0.02 0.08 -0.04 -0.05 0.02 -0.35 0.09 0.07 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.01 -0.00 -0.01 0.02 0.01 -0.00 -0.00 0.00 -0.00 0.00 0.01 -0.02 -0.00 -0.01 -0.02 0.00 -0.01 0.02 -0.00 -0.01 0.00 -0.00 -0.00 -0.01 -0.01 0.01 0.00 0.01 -0.01 -0.00 0.00 0.00 -0.00 0.00 0.00 0.01 -0.00 -0.00 0.00 -0.00 -0.00 -0.02 0.00 0.01 -0.02 0.00 0.01 -0.04 0.04 0.01 -0.04 -0.03 0.02 0.02 -0.02 -0.01 0.00 0.02 -0.00 -0.00 -0.01 0.00 0.01 -0.01 -0.00 0.01 -0.18 0.01 0.02 0.02 -0.01 -0.00 -0.01 0.00 0.00 0.01 -0.00 -0.00 -0.02 0.00 0.02 0.02 -0.01 0.01 0.00 -0.00 0.03 0.16 -0.03 0.02 0.01 -0.01 0.02 -0.03 -0.00 0.02 -0.00 -0.01 -0.10 -0.02 0.03 -0.09 0.04 0.02 -0.34 -0.26 0.11 -0.28 0.30 0.05 0.08 0.08 -0.03 0.45 0.19 -0.12 0.07 -0.09 -0.01 0.42 -0.27 -0.08 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.01 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.00 0.01 0.01 -0.00 0.01 -0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.01 -0.00 0.00 -0.00 0.03 -0.00 -0.01 0.04 -0.00 -0.01 0.03 -0.01 -0.01 -0.06 0.15 0.01 -0.09 -0.13 0.04 -0.05 -0.02 0.02 -0.04 0.03 0.01 0.00 -0.03 0.00 0.01 0.06 -0.01 -0.03 0.01 0.01 0.06 0.04 -0.02 -0.01 -0.17 0.01 0.50 0.28 -0.18 -0.20 0.15 0.06 -0.02 -0.00 0.01 0.00 -0.07 0.01 -0.00 0.03 -0.00 0.04 -0.05 -0.01 0.00 0.14 -0.02 -0.18 -0.09 0.07 0.44 -0.37 -0.11 0.03 -0.00 -0.01 -0.03 0.02 0.00 -0.03 -0.02 0.01 0.05 0.11 -0.02 0.03 -0.11 0.00 0.00 -0.05 0.00 -0.03 -0.06 0.01 0.01 0.05 -0.01 -0.02 0.07 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.01 -0.01 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.01 -0.01 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 0.09 -0.01 -0.07 -0.00 0.02 0.07 -0.03 -0.02 0.10 0.01 -0.03 -0.10 0.03 0.03 -0.06 0.02 0.02 -0.03 -0.00 0.01 0.03 -0.03 -0.01 -0.06 -0.01 0.02 -0.04 0.44 -0.01 -0.20 -0.07 0.07 0.33 -0.27 -0.10 -0.04 -0.02 0.01 0.03 -0.01 -0.01 0.06 0.02 -0.02 0.06 -0.03 -0.02 0.10 0.45 -0.08 -0.36 -0.19 0.15 0.24 -0.16 -0.07 -0.00 -0.01 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.03 -0.03 0.01 0.02 -0.03 -0.00 -0.01 0.01 0.00 0.01 0.01 -0.00 0.01 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.01 -0.00 0.01 0.01 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.01 0.00 -0.00 -0.00 -0.00 0.01 -0.01 -0.00 -0.00 0.00 0.00 0.01 -0.00 -0.00 0.01 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.01 -0.00 -0.00 0.00 -0.00 0.00 0.02 0.05 0.01 0.14 -0.04 0.01 -0.09 -0.04 0.13 0.27 0.07 0.20 0.21 0.13 -0.35 -0.06 -0.01 -0.01 -0.10 0.24 0.07 0.16 0.23 -0.07 0.18 -0.35 0.04 0.10 -0.04 -0.02 -0.09 0.05 -0.16 0.24 -0.05 -0.07 0.29 0.18 0.31 -0.12 -0.01 -0.00 0.00 0.02 -0.00 -0.01 0.12 -0.01 -0.04 -0.08 -0.13 0.04 -0.06 0.15 0.01 -0.08 0.07 0.02 -0.09 -0.05 0.04 0.08 -0.01 -0.03 0.04 -0.02 -0.01 -0.03 0.00 0.01 0.03 -0.05 -0.01 0.06 -0.43 -0.00 -0.24 -0.15 0.09 -0.19 0.12 0.06 -0.03 -0.00 0.01 0.04 0.01 -0.01 0.08 0.00 -0.03 0.04 0.04 -0.02 0.13 0.45 -0.09 -0.22 -0.09 0.09 -0.19 0.18 0.05 0.10 -0.01 -0.02 -0.06 0.04 0.01 -0.06 -0.03 0.02 0.02 0.13 -0.01 -0.01 -0.12 0.01 0.01 -0.10 0.00 -0.18 -0.17 0.06 0.03 0.10 -0.01 -0.15 0.20 0.02 0.00 0.00 0.01 -0.00 0.00 -0.00 -0.00 0.00 0.02 0.00 0.01 0.01 -0.00 -0.01 -0.00 -0.00 -0.00 -0.00 0.01 0.00 0.01 0.01 -0.00 0.01 -0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.01 0.01 -0.00 0.00 0.02 0.00 0.01 -0.00 0.02 0.23 -0.02 -0.00 -0.02 0.00 0.01 0.21 -0.02 -0.02 -0.16 0.02 -0.00 -0.17 0.01 -0.01 -0.18 0.01 -0.02 -0.19 0.02 -0.03 0.01 0.01 -0.06 0.01 0.02 0.05 -0.00 -0.02 0.02 0.09 -0.01 -0.02 0.18 0.00 0.40 0.22 -0.15 -0.03 0.07 0.01 -0.05 0.01 0.02 0.06 -0.01 -0.02 0.03 0.00 -0.01 -0.00 0.09 -0.01 0.05 0.17 -0.04 0.07 0.08 -0.03 -0.36 0.29 0.09 0.01 0.07 -0.01 -0.02 -0.02 0.01 0.01 -0.02 -0.00 0.09 0.09 -0.03 -0.08 0.11 0.01 0.00 -0.02 0.00 -0.26 -0.09 0.07 0.00 -0.02 0.00 0.23 -0.13 -0.05 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.01 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.02 -0.01 -0.01 -0.02 0.05 0.00 -0.03 -0.04 0.01 0.03 0.17 -0.02 0.01 -0.17 0.01 -0.00 -0.06 0.00 -0.00 0.03 0.00 -0.03 -0.05 0.01 -0.02 0.00 0.01 0.01 0.18 -0.01 0.01 0.04 -0.00 0.42 -0.43 -0.13 -0.02 0.06 -0.00 -0.01 -0.03 0.01 0.01 0.06 -0.01 -0.02 -0.01 0.01 -0.02 -0.19 0.02 0.48 0.33 -0.20 0.01 -0.05 0.00 0.08 -0.00 -0.02 -0.04 0.01 0.01 -0.04 -0.01 0.01 -0.01 0.05 -0.00 -0.04 -0.02 0.01 0.02 -0.04 -0.00 -0.15 -0.10 0.05 0.02 0.04 -0.01 -0.11 0.12 0.02 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.01 0.01 0.01 0.00 0.01 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.01 -0.01 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.01 -0.00 -0.00 0.01 0.00 0.00 -0.00 0.00 0.05 -0.00 0.00 -0.01 -0.00 0.02 0.01 -0.01 -0.01 -0.04 0.01 -0.02 -0.04 0.01 -0.02 0.00 0.00 0.02 -0.02 -0.01 0.00 -0.01 -0.00 -0.01 0.01 0.00 0.01 -0.02 -0.00 0.01 0.03 -0.00 0.00 -0.02 0.00 0.06 0.04 -0.02 0.06 -0.06 -0.02 -0.03 -0.02 0.01 0.02 -0.01 -0.01 -0.00 0.01 -0.00 0.00 0.05 -0.01 -0.01 -0.03 0.00 -0.05 -0.03 0.02 -0.07 0.05 0.02 -0.02 -0.11 0.02 0.07 0.05 -0.02 -0.04 0.06 0.01 -0.29 -0.32 0.10 0.26 -0.37 -0.04 -0.03 0.02 0.01 0.48 0.16 -0.13 0.01 0.01 -0.00 -0.43 0.23 0.09 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.03 0.01 -0.01 -0.07 0.01 0.02 -0.21 0.02 0.06 0.17 -0.03 -0.06 0.16 -0.03 -0.06 -0.10 -0.09 0.04 -0.07 0.10 0.02 0.02 0.14 -0.01 -0.10 -0.10 0.04 0.09 -0.10 -0.03 -0.04 0.17 0.01 0.01 -0.09 0.01 0.17 0.01 -0.06 0.06 -0.08 -0.02 0.09 0.07 -0.04 -0.07 0.11 0.01 -0.01 -0.14 0.02 -0.06 -0.13 0.04 0.02 0.07 -0.01 0.04 0.04 -0.02 0.14 -0.03 -0.05 0.24 -0.06 -0.06 -0.13 0.03 0.03 -0.17 0.03 0.04 -0.21 -0.02 0.06 -0.07 -0.15 0.03 0.11 -0.08 -0.02 -0.19 -0.18 0.06 0.13 0.06 -0.04 -0.41 0.34 0.08 0.01 -0.00 -0.00 -0.01 0.00 0.00 -0.00 0.02 0.02 0.01 -0.02 -0.02 0.00 -0.02 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.02 -0.00 -0.01 -0.01 0.00 0.00 0.02 0.02 -0.02 -0.01 -0.02 0.02 0.00 0.01 -0.00 0.02 0.26 -0.03 -0.00 0.00 0.00 -0.01 0.00 0.00 0.24 -0.12 -0.07 -0.25 -0.06 0.09 0.20 0.08 -0.07 -0.18 0.12 0.05 -0.03 -0.25 0.02 0.09 0.14 -0.04 -0.12 0.15 0.04 0.03 -0.19 -0.00 -0.01 0.33 -0.02 0.08 0.15 -0.03 0.11 -0.05 -0.03 0.14 0.11 -0.06 -0.07 0.16 0.01 -0.01 -0.25 0.03 -0.06 -0.17 0.04 0.06 0.32 -0.05 -0.13 -0.04 0.05 -0.06 0.16 0.00 0.00 -0.03 0.00 0.01 0.01 -0.00 -0.02 0.01 0.00 -0.03 -0.04 0.01 0.02 -0.04 -0.00 0.02 0.01 -0.01 0.06 0.02 -0.02 -0.01 0.01 0.00 -0.07 0.04 0.01 -0.00 -0.04 0.00 0.00 0.02 0.00 0.00 -0.01 0.00 -0.02 0.04 0.01 -0.03 0.00 0.01 0.00 0.02 -0.00 0.04 -0.02 -0.03 -0.04 -0.01 0.03 -0.00 -0.07 0.01 -0.00 0.02 -0.01 0.03 0.03 -0.02 -0.00 -0.01 -0.00 0.02 -0.00 -0.01 0.00 0.00 0.00 0.00 -0.00 -0.00 0.02 -0.00 -0.01 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.01 0.00 0.00 -0.01 -0.00 0.00 0.00 0.01 -0.00 -0.00 -0.00 0.00 0.00 -0.01 -0.00 0.00 0.01 -0.00 0.00 -0.03 0.00 -0.00 -0.00 0.00 0.01 -0.01 -0.00 0.01 0.01 -0.00 -0.00 0.00 0.00 0.00 -0.01 -0.00 -0.00 -0.01 0.00 0.01 0.03 -0.01 0.01 0.01 -0.00 -0.00 0.00 0.00 -0.01 0.00 0.00 0.01 0.00 -0.00 0.01 -0.00 -0.00 0.01 -0.00 -0.00 0.01 0.00 -0.00 -0.01 0.00 0.00 0.02 0.01 -0.01 -0.01 -0.00 0.00 0.02 -0.02 -0.01 0.29 -0.03 -0.10 -0.12 0.00 0.07 -0.08 0.38 -0.05 0.18 -0.15 0.05 0.31 0.24 -0.13 -0.12 0.01 -0.01 -0.14 0.04 0.02 -0.14 -0.01 0.02 -0.20 0.02 0.05 -0.12 0.03 0.07 0.20 0.13 0.02 -0.14 -0.37 0.03 0.26 -0.30 -0.07 0.00 0.01 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.01 -0.01 -0.00 -0.01 -0.00 0.00 0.01 0.00 -0.00 -0.01 0.01 0.00 -0.00 -0.01 0.00 0.00 0.01 -0.00 -0.01 0.01 0.00 0.00 -0.01 0.00 0.00 0.01 -0.00 0.00 0.01 -0.00 0.01 -0.00 -0.00 0.01 0.00 -0.00 -0.00 0.01 0.00 -0.00 -0.01 0.00 -0.00 -0.01 0.00 0.00 0.01 -0.00 -0.01 -0.00 0.00 -0.00 0.01 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.01 -0.01 0.00 0.01 -0.01 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.01 -0.00 -0.00 -0.00 -0.01 0.00 0.01 0.02 0.31 -0.03 -0.03 -0.12 -0.02 -0.02 0.05 -0.07 0.18 -0.24 -0.04 0.25 -0.07 -0.12 -0.01 -0.14 0.01 -0.27 0.14 0.19 0.28 0.06 -0.21 0.04 0.46 -0.05 0.02 -0.12 0.05 -0.22 -0.20 0.09 0.03 0.06 0.06 -0.26 -0.01 0.12 0.01 0.00 -0.00 -0.01 0.00 0.00 0.26 -0.03 -0.08 0.01 0.02 -0.01 0.00 -0.03 0.00 -0.14 0.05 0.04 -0.15 -0.02 0.05 0.06 0.10 -0.02 -0.06 -0.06 0.02 0.05 -0.14 -0.01 0.01 0.16 -0.01 0.04 -0.31 0.00 0.02 -0.03 -0.00 0.21 -0.27 -0.06 0.07 0.12 -0.04 -0.05 0.07 0.01 0.04 -0.11 -0.00 -0.01 -0.16 0.02 0.09 0.31 -0.06 0.25 0.22 -0.11 0.02 0.03 -0.01 -0.12 0.01 0.03 0.10 0.00 -0.03 0.11 -0.02 -0.03 0.10 -0.02 -0.03 0.09 0.02 -0.03 -0.11 0.03 0.03 0.25 0.14 -0.08 -0.11 -0.00 0.03 0.25 -0.19 -0.05 -0.04 0.00 0.01 0.01 -0.00 -0.01 0.01 -0.05 -0.00 -0.02 0.02 -0.00 -0.03 -0.03 0.01 0.01 -0.00 0.00 0.02 -0.00 0.00 0.02 0.00 0.00 0.04 -0.00 -0.01 0.01 -0.00 -0.01 -0.03 -0.02 0.00 0.02 0.05 -0.01 -0.03 0.03 0.01 -0.00 -0.07 0.01 0.00 0.01 -0.00 0.01 0.16 -0.02 -0.03 0.03 0.01 0.03 0.02 -0.01 0.05 -0.08 -0.01 -0.06 -0.07 0.03 -0.03 0.03 0.01 0.04 0.02 -0.01 0.02 0.05 -0.01 -0.02 -0.10 0.01 -0.04 -0.03 0.02 -0.17 -0.07 0.06 -0.43 0.42 0.13 -0.01 0.05 -0.00 -0.03 0.02 0.01 0.04 0.03 -0.02 0.00 -0.10 0.01 0.04 -0.04 -0.01 0.48 0.32 -0.20 0.15 -0.10 -0.04 -0.00 -0.01 0.00 0.04 0.02 -0.01 -0.04 0.03 0.01 -0.11 -0.13 0.04 0.09 -0.15 -0.01 0.00 -0.01 0.00 0.08 0.01 -0.02 -0.00 -0.01 0.00 -0.07 0.02 0.02 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.01 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.01 -0.00 -0.00 0.00 -0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.01 0.00 -0.01 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.01 -0.00 -0.00 -0.03 0.05 0.02 -0.04 -0.27 -0.04 0.19 -0.19 -0.13 0.12 -0.19 0.01 -0.11 0.01 0.02 0.43 -0.25 0.01 0.46 0.18 -0.03 0.34 -0.05 -0.20 -0.03 -0.03 0.02 0.16 0.10 -0.12 -0.00 0.19 -0.07 0.11 0.12 -0.02 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.01 0.00 -0.02 0.00 0.01 0.02 -0.00 -0.01 -0.01 0.01 0.00 0.01 0.01 -0.01 -0.00 -0.01 0.00 -0.01 0.00 0.00 0.00 0.01 -0.00 0.00 -0.01 -0.00 0.00 0.05 -0.00 0.03 0.02 -0.01 -0.01 0.02 0.00 -0.00 0.01 0.00 0.01 0.00 -0.00 0.00 -0.01 0.00 -0.00 -0.01 0.00 0.00 0.05 -0.01 0.01 0.02 -0.01 -0.03 0.03 0.01 0.00 0.00 -0.00 0.01 0.00 -0.00 -0.00 0.00 0.00 -0.01 -0.01 0.00 0.00 -0.01 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.01 -0.00 0.00 0.01 -0.00 0.03 -0.08 -0.02 0.05 0.41 0.04 -0.27 0.25 0.19 -0.12 0.27 -0.03 -0.01 -0.01 0.00 0.02 -0.02 0.01 0.05 0.01 -0.01 0.03 0.01 -0.02 -0.04 -0.08 0.04 0.33 0.18 -0.25 0.01 0.44 -0.14 0.19 0.28 -0.03 0.00 0.01 -0.00 -0.00 -0.02 0.00 -0.00 -0.07 0.01 -0.14 0.03 0.05 0.15 0.00 -0.05 -0.12 0.09 0.04 0.12 0.06 -0.05 -0.01 -0.09 0.01 -0.10 0.02 0.03 0.04 0.07 -0.02 0.02 -0.10 -0.00 0.03 0.46 -0.03 0.28 0.20 -0.10 -0.09 0.18 0.02 -0.03 0.07 0.00 0.09 0.00 -0.03 -0.00 -0.09 0.01 -0.03 -0.09 0.02 0.04 0.45 -0.06 0.11 0.15 -0.05 -0.23 0.24 0.06 -0.00 -0.00 0.00 0.03 0.01 -0.01 -0.03 0.01 0.01 -0.03 -0.06 0.01 0.02 -0.06 -0.00 0.02 -0.00 -0.01 -0.03 -0.03 0.01 -0.02 0.00 0.01 0.03 -0.03 -0.00 0.00 0.00 -0.00 -0.01 0.02 0.00 -0.01 -0.12 0.01 0.09 -0.07 -0.04 0.02 -0.06 0.01 0.00 0.00 -0.00 -0.03 -0.00 -0.03 0.03 -0.00 0.03 -0.00 -0.05 0.01 0.01 0.02 -0.01 -0.10 -0.05 0.06 -0.00 -0.12 0.01 -0.03 -0.06 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.01 0.00 0.02 0.02 0.13 -0.24 -0.24 0.04 -0.09 0.11 -0.16 0.00 -0.02 -0.00 -0.04 -0.00 0.31 0.37 -0.04 -0.22 0.43 0.36 -0.05 -0.20 0.01 0.00 0.02 -0.25 -0.02 -0.09 -0.00 -0.18 -0.21 0.13 0.14 -0.03 -0.00 -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.02 0.02 -0.01 -0.01 0.02 0.00 0.00 -0.02 -0.00 -0.01 -0.02 0.00 0.01 0.01 -0.00 0.00 -0.02 0.00 -0.02 0.01 0.01 0.01 0.02 -0.00 0.01 -0.03 -0.00 0.03 -0.01 -0.01 0.11 -0.10 -0.03 0.02 0.00 -0.01 -0.00 -0.02 0.00 -0.01 0.01 0.00 -0.00 0.02 -0.00 -0.02 -0.02 0.01 -0.12 -0.08 0.05 -0.03 -0.00 0.01 -0.01 -0.04 0.00 0.15 0.02 -0.04 -0.14 0.05 0.03 -0.07 -0.22 0.04 0.04 -0.23 0.01 0.16 -0.00 -0.04 -0.37 -0.17 0.10 -0.16 0.03 0.04 0.34 -0.24 -0.07 -0.00 -0.00 0.00 0.00 0.01 0.02 0.01 0.11 -0.24 -0.22 0.01 -0.12 0.12 -0.19 0.01 0.00 0.00 0.00 -0.02 -0.01 -0.02 0.03 -0.00 0.02 -0.01 -0.05 0.01 -0.00 0.00 -0.03 0.22 -0.00 0.12 0.01 0.16 0.22 -0.15 -0.17 0.03 -0.00 -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.01 0.01 -0.00 -0.01 0.01 0.00 0.00 -0.01 -0.00 -0.00 -0.01 0.00 0.00 0.00 -0.00 0.00 -0.01 -0.00 -0.01 0.00 0.00 0.00 0.01 -0.00 0.00 -0.02 -0.00 0.00 -0.01 -0.00 0.04 -0.04 -0.01 0.01 -0.00 -0.00 -0.00 -0.01 0.00 -0.00 0.00 0.00 -0.00 0.01 -0.00 -0.01 -0.01 0.00 -0.04 -0.03 0.02 -0.01 -0.00 0.00 -0.00 -0.01 0.00 0.05 0.01 -0.01 -0.05 0.02 0.01 -0.02 -0.07 0.01 0.01 -0.07 0.00 0.05 -0.00 -0.01 -0.12 -0.05 0.03 -0.05 0.01 0.01 0.11 -0.07 -0.02 0.00 0.00 -0.00 -0.01 -0.01 -0.04 -0.02 -0.19 0.38 0.36 -0.01 0.19 -0.18 0.31 -0.02 0.00 -0.00 0.00 0.03 0.00 0.02 -0.03 0.00 -0.03 -0.00 0.05 -0.00 0.01 -0.00 0.04 -0.35 0.01 -0.19 -0.01 -0.26 -0.33 0.22 0.28 -0.04 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.01 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.01 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.01 0.00 -0.01 -0.01 0.00 0.00 -0.01 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.02 -0.00 0.00 0.01 -0.00 -0.01 0.01 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.02 -0.02 0.05 -0.01 -0.05 -0.34 0.18 0.36 -0.16 -0.02 -0.02 0.01 0.01 0.04 -0.01 -0.03 -0.22 0.31 0.21 -0.26 -0.23 0.27 0.04 -0.00 -0.02 -0.03 -0.04 0.00 0.38 0.10 -0.04 0.00 0.37 0.11 -0.02 -0.00 0.01 -0.02 0.00 0.01 -0.03 0.00 0.01 0.10 -0.01 -0.03 0.14 -0.06 -0.05 0.14 0.03 -0.05 -0.13 0.09 0.04 -0.14 -0.07 0.06 0.01 -0.09 0.00 -0.12 0.01 0.04 0.07 0.04 -0.03 0.00 -0.10 0.00 0.04 0.40 -0.03 0.26 0.19 -0.10 -0.14 0.23 0.04 0.07 -0.06 -0.02 -0.12 0.01 0.04 0.02 0.09 -0.02 0.02 0.10 -0.02 -0.02 -0.43 0.05 -0.18 -0.21 0.09 0.24 -0.26 -0.06 -0.02 0.00 0.01 0.01 0.01 -0.00 0.00 -0.01 -0.00 -0.01 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.01 -0.01 0.00 -0.01 0.01 0.00 -0.00 0.01 -0.00 -0.01 -0.00 -0.00 -0.00 -0.00 -0.00 -0.01 -0.06 -0.00 0.05 0.02 0.05 0.03 0.05 -0.02 -0.00 -0.00 -0.00 0.01 0.04 0.06 0.00 -0.03 0.06 0.06 -0.00 -0.04 -0.00 0.00 -0.00 0.05 -0.01 0.05 0.00 0.05 -0.02 0.03 -0.05 -0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.02 0.02 0.01 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.02 0.01 -0.01 0.00 0.00 -0.00 -0.00 -0.02 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.01 0.01 -0.00 -0.01 0.01 0.00 0.01 0.01 -0.00 -0.01 0.00 0.01 -0.01 0.01 0.00 0.01 0.00 -0.01 0.00 -0.00 0.00 0.03 0.02 -0.01 0.02 0.13 0.22 -0.10 -0.13 -0.25 -0.33 -0.19 0.15 -0.00 -0.03 0.00 0.21 0.03 0.21 -0.20 0.02 -0.21 0.03 0.42 -0.04 -0.03 0.02 0.00 0.09 -0.09 0.27 -0.01 0.08 -0.24 0.30 -0.26 -0.10 -0.04 0.00 0.01 0.03 -0.00 -0.01 -0.01 0.00 0.00 -0.05 -0.12 0.03 -0.03 0.13 0.00 -0.04 -0.13 0.02 -0.02 0.13 -0.01 0.05 -0.07 -0.01 -0.05 -0.06 0.02 -0.08 0.10 0.02 0.06 0.03 -0.02 0.08 0.12 -0.03 0.30 0.08 -0.11 0.42 -0.31 -0.13 -0.09 -0.08 0.04 -0.04 0.07 0.01 0.06 0.06 -0.03 0.06 -0.04 -0.02 0.05 -0.14 -0.01 0.45 0.21 -0.18 0.29 -0.15 -0.08 -0.02 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.01 0.00 -0.00 0.01 0.01 -0.00 0.01 -0.00 -0.00 0.01 -0.01 -0.00 0.01 -0.00 -0.00 -0.00 0.01 0.00 -0.00 0.01 0.01 -0.01 -0.03 -0.05 -0.02 -0.04 0.02 0.00 -0.00 -0.00 -0.02 0.00 -0.01 -0.02 -0.00 -0.01 -0.03 0.01 0.01 -0.00 -0.01 0.00 -0.01 0.02 -0.05 -0.00 -0.01 0.01 -0.02 0.05 0.01 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.01 0.00 0.00 -0.01 -0.00 0.00 -0.01 0.00 0.00 0.00 -0.01 -0.00 0.01 0.01 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 -0.00 0.00 -0.01 -0.00 0.00 -0.00 -0.00 0.02 -0.02 -0.01 -0.01 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.01 0.00 0.00 0.01 -0.00 0.02 0.01 -0.01 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.01 -0.00 -0.02 0.02 -0.06 -0.03 0.02 0.09 0.26 0.08 0.13 0.24 -0.20 0.39 -0.04 -0.06 0.00 -0.00 0.18 0.03 0.19 0.17 -0.02 0.19 0.35 -0.05 -0.20 0.02 0.05 -0.04 0.06 -0.09 0.26 0.01 -0.04 0.27 -0.25 -0.35 0.03 -0.00 -0.02 0.00 0.00 0.00 -0.00 0.00 0.01 -0.00 0.00 0.03 -0.00 0.00 0.03 -0.00 -0.00 -0.02 0.00 0.00 -0.02 0.00 0.01 -0.01 -0.00 -0.01 -0.01 0.00 -0.02 0.02 0.00 0.01 -0.00 -0.00 0.01 0.03 -0.01 0.05 0.01 -0.02 0.07 -0.05 -0.02 0.02 0.02 -0.01 0.01 -0.01 -0.00 -0.01 -0.01 0.00 -0.01 0.00 0.00 -0.01 0.04 -0.00 -0.08 -0.03 0.03 -0.05 0.02 0.02 0.01 0.07 -0.01 0.01 0.01 -0.00 -0.01 0.01 0.00 -0.05 -0.05 0.02 0.04 -0.06 -0.01 -0.02 -0.03 0.01 0.03 -0.02 -0.01 0.02 -0.04 -0.00 -0.04 -0.01 0.01 -0.01 -0.06 0.01 -0.02 0.01 0.01 -0.01 -0.09 -0.20 0.02 0.13 0.17 0.23 0.12 -0.09 -0.00 -0.03 0.00 0.33 0.03 0.26 -0.32 0.03 -0.27 0.04 0.52 -0.05 0.02 0.01 -0.02 0.01 0.09 -0.17 0.00 -0.04 0.20 -0.18 0.14 0.05 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.01 -0.00 0.00 -0.01 -0.00 0.00 0.00 -0.01 -0.00 0.00 0.01 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.01 -0.00 -0.00 -0.01 0.00 -0.00 -0.00 0.00 0.02 -0.02 -0.00 -0.01 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.01 0.00 0.00 0.01 -0.00 0.03 0.02 -0.01 0.01 0.00 -0.00 -0.01 -0.01 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 0.01 0.00 -0.00 -0.02 -0.00 0.01 0.01 0.00 -0.00 -0.01 0.01 0.01 -0.06 0.01 0.02 -0.02 -0.02 0.00 -0.02 -0.21 -0.30 0.09 0.19 0.30 0.39 0.17 -0.17 0.03 -0.00 0.00 -0.00 -0.01 -0.03 0.01 0.01 -0.02 0.00 -0.01 0.02 -0.02 0.02 -0.00 0.06 -0.14 0.34 0.01 0.15 -0.35 0.37 -0.27 -0.13 -0.00 -0.07 0.01 0.00 0.01 -0.00 0.00 0.03 -0.00 0.02 0.08 -0.01 -0.01 0.08 -0.00 -0.00 -0.07 0.00 -0.01 -0.07 0.01 0.02 -0.03 -0.01 -0.01 -0.03 0.00 -0.06 0.06 0.02 0.03 0.00 -0.01 0.03 0.05 -0.01 0.12 0.02 -0.04 0.22 -0.16 -0.07 0.06 0.05 -0.03 0.00 -0.03 0.00 -0.03 -0.02 0.01 -0.03 0.01 0.01 -0.02 0.06 0.00 -0.24 -0.11 0.09 -0.12 0.05 0.04 0.02 0.24 -0.02 0.03 0.04 -0.01 -0.03 0.04 0.00 -0.16 -0.17 0.05 0.14 -0.20 -0.02 -0.07 -0.11 0.03 0.11 -0.06 -0.02 0.05 -0.12 -0.00 -0.12 -0.04 0.03 0.00 0.04 -0.00 0.02 -0.01 -0.01 0.01 0.07 0.17 -0.02 -0.10 -0.15 -0.20 -0.11 0.08 0.00 0.01 -0.00 -0.19 -0.02 -0.15 0.19 -0.01 0.15 -0.02 -0.29 0.03 -0.02 0.00 0.01 0.02 -0.08 0.19 -0.00 0.05 -0.20 0.21 -0.17 -0.06 0.01 0.12 -0.01 -0.00 -0.01 0.00 -0.01 -0.17 0.02 -0.04 -0.14 0.03 0.01 -0.15 0.00 0.01 0.14 -0.01 0.01 0.14 -0.02 -0.05 0.04 0.02 0.06 0.07 -0.02 0.06 -0.12 -0.02 -0.05 0.02 0.02 -0.07 -0.10 0.03 -0.27 -0.07 0.10 -0.28 0.16 0.09 -0.08 -0.10 0.04 -0.05 0.08 0.01 0.06 0.02 -0.02 0.05 0.01 -0.02 0.06 -0.12 -0.01 0.31 0.09 -0.12 0.26 -0.12 -0.08 0.02 0.28 -0.03 0.08 0.04 -0.02 -0.07 0.06 0.01 -0.16 -0.22 0.06 0.13 -0.25 -0.01 -0.01 -0.12 0.01 -0.11 -0.17 0.04 -0.00 -0.12 0.01 0.08 -0.18 -0.01 -0.00 -0.01 0.00 -0.00 0.00 0.00 -0.00 -0.01 -0.01 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.02 0.00 0.02 -0.02 0.00 -0.02 0.00 0.03 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.01 0.01 -0.01 0.00 -0.00 -0.01 0.00 0.00 0.01 -0.00 -0.00 0.11 -0.01 -0.03 0.00 0.02 -0.00 0.00 -0.02 0.00 -0.01 0.01 0.00 -0.01 -0.01 0.01 -0.00 0.02 -0.00 0.00 -0.01 -0.00 -0.00 -0.00 0.00 0.00 0.01 -0.00 -0.01 -0.04 0.00 -0.01 -0.02 0.01 0.01 -0.02 -0.00 -0.00 0.01 0.00 0.01 0.00 -0.00 -0.01 -0.02 0.00 0.00 -0.01 0.00 -0.00 0.05 -0.00 0.01 0.02 -0.01 -0.02 0.02 0.00 -0.31 0.03 0.09 -0.10 -0.30 0.05 -0.05 0.32 -0.01 0.35 0.10 -0.10 0.33 -0.15 -0.07 0.16 -0.02 -0.04 -0.33 -0.18 0.10 0.17 -0.01 -0.04 -0.31 0.26 0.06 0.01 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.01 0.03 -0.00 -0.02 -0.02 -0.03 -0.01 0.02 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.01 0.00 -0.00 -0.00 -0.00 0.01 -0.03 -0.00 -0.01 0.03 -0.03 0.02 0.01 0.00 0.05 -0.00 -0.00 -0.02 0.00 0.00 0.04 -0.00 -0.18 -0.02 0.06 0.17 -0.06 -0.06 -0.17 -0.07 0.06 0.16 -0.11 -0.04 -0.14 -0.05 0.05 0.26 0.09 -0.09 -0.18 0.03 0.06 0.08 0.05 -0.03 -0.15 0.06 0.05 -0.33 -0.17 0.12 0.13 -0.25 -0.03 0.19 -0.00 -0.06 -0.24 0.15 0.07 0.13 -0.08 -0.04 -0.07 0.06 0.02 0.16 0.03 -0.06 -0.17 -0.22 0.08 0.30 -0.23 -0.08 -0.00 -0.05 0.00 -0.01 -0.01 0.00 0.01 -0.00 -0.00 0.02 0.03 -0.01 -0.01 0.03 0.00 0.00 0.02 -0.00 0.02 0.03 -0.01 0.00 0.02 -0.00 -0.02 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.01 0.00 0.01 -0.01 0.00 -0.01 0.00 0.02 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.02 0.00 0.01 -0.03 0.00 0.01 0.06 -0.01 -0.02 0.19 -0.00 -0.07 0.19 -0.04 -0.06 -0.19 -0.06 0.07 -0.18 0.09 0.05 -0.13 -0.08 0.05 0.24 0.11 -0.09 -0.14 -0.01 0.05 0.07 0.07 -0.03 -0.15 0.11 0.05 -0.33 -0.14 0.12 0.06 -0.19 -0.01 -0.14 0.03 0.04 0.22 -0.16 -0.06 -0.12 0.11 0.03 0.06 -0.08 -0.01 -0.16 -0.08 0.06 0.09 0.18 -0.05 -0.30 0.20 0.08 -0.07 0.01 0.02 0.01 0.09 -0.01 -0.00 -0.09 0.01 -0.13 -0.03 0.04 -0.12 0.05 0.03 0.04 0.02 -0.01 -0.17 -0.04 0.04 0.04 -0.03 -0.01 -0.16 0.08 0.03 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.01 -0.00 -0.01 -0.01 -0.01 -0.01 0.01 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.01 -0.00 -0.00 0.01 -0.01 0.01 0.00 0.00 -0.00 -0.00 -0.01 0.00 0.00 -0.05 0.01 0.02 0.02 -0.04 -0.00 0.03 0.04 -0.01 -0.03 -0.03 0.01 -0.03 0.04 0.01 -0.03 -0.08 0.01 0.05 0.05 -0.02 0.00 -0.03 0.00 0.00 0.04 -0.00 -0.02 0.11 0.00 -0.07 0.00 0.03 -0.04 0.00 0.01 0.00 0.03 -0.00 0.04 -0.06 -0.01 -0.02 0.09 -0.00 -0.00 -0.03 0.00 -0.04 -0.10 0.02 -0.04 0.01 0.01 -0.07 0.01 0.02 0.22 -0.02 -0.06 -0.02 -0.22 0.02 0.01 0.23 -0.02 0.32 0.07 -0.09 0.31 -0.13 -0.07 -0.13 -0.06 0.04 0.46 0.10 -0.12 -0.12 0.09 0.02 0.44 -0.20 -0.10 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.01 -0.02 0.00 0.01 0.02 0.03 0.01 -0.01 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.01 0.02 0.00 0.00 -0.02 0.03 -0.01 -0.01 0.17 -0.01 -0.06 -0.12 0.01 0.04 -0.00 -0.00 -0.00 0.09 0.11 -0.04 0.08 -0.17 -0.02 -0.05 0.09 0.01 -0.06 -0.06 0.03 0.00 0.25 -0.01 0.01 -0.14 0.00 -0.18 0.23 0.05 0.07 -0.19 -0.01 -0.03 -0.28 0.02 0.11 -0.12 -0.03 0.30 -0.18 -0.09 -0.18 -0.15 0.08 0.04 0.10 -0.02 -0.03 -0.19 0.03 0.08 0.14 -0.04 0.01 0.22 -0.03 0.27 0.09 -0.10 0.10 0.08 -0.04 0.08 -0.01 -0.02 -0.00 -0.06 0.01 0.01 0.06 -0.01 0.09 0.02 -0.03 0.09 -0.04 -0.02 -0.05 -0.02 0.02 0.19 0.05 -0.05 -0.05 0.03 0.01 0.18 -0.08 -0.04 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.01 0.00 0.00 0.00 0.01 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.01 0.01 -0.00 -0.00 -0.01 0.08 -0.00 0.01 -0.02 -0.00 -0.00 -0.01 0.00 -0.08 -0.20 0.05 0.04 -0.19 -0.00 0.01 0.08 -0.01 0.01 0.10 -0.01 0.02 0.27 -0.02 -0.03 -0.14 0.02 -0.11 0.17 0.03 0.04 -0.15 -0.01 -0.01 -0.31 0.02 0.13 -0.10 -0.04 0.24 -0.11 -0.07 0.17 0.18 -0.08 0.01 -0.17 0.01 0.03 0.31 -0.04 -0.08 -0.17 0.05 -0.04 -0.37 0.05 -0.31 -0.08 0.11 -0.16 -0.09 0.07 -0.01 0.01 0.00 -0.00 0.01 -0.00 0.00 -0.00 0.00 -0.01 -0.00 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.01 -0.00 -0.00 -0.03 0.01 0.01 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.01 -0.00 -0.00 -0.00 -0.00 0.00 0.01 0.00 0.01 -0.01 0.00 -0.01 0.00 0.01 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.01 -0.01 -0.00 0.00 0.71 -0.08 -0.23 -0.45 0.05 0.15 0.04 -0.00 -0.01 -0.13 -0.09 0.05 -0.11 0.11 0.03 0.01 -0.05 0.00 0.01 0.05 -0.01 0.03 -0.14 -0.00 0.01 0.06 -0.00 0.02 -0.05 -0.01 -0.01 0.05 0.00 0.06 0.15 -0.03 0.01 0.07 -0.01 -0.06 0.02 0.02 0.03 0.04 -0.02 -0.00 -0.06 0.01 0.05 0.13 -0.03 -0.02 -0.05 0.01 0.04 -0.16 0.00 -0.06 -0.01 0.02 0.00 -0.07 0.01 -0.08 0.01 0.02 0.01 0.02 -0.00 0.00 -0.02 0.00 -0.03 -0.01 0.01 -0.03 0.01 0.01 0.03 0.01 -0.01 -0.07 -0.00 0.02 0.03 -0.02 -0.01 -0.07 0.02 0.02 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.00 0.01 -0.00 -0.00 0.00 -0.00 0.01 -0.00 0.00 0.01 -0.00 0.00 0.01 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.01 -0.00 -0.00 0.00 -0.00 -0.01 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.01 -0.02 -0.04 -0.21 0.01 -0.01 0.07 0.14 -0.13 0.21 0.11 0.62 0.00 0.00 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 -0.01 -0.00 -0.02 0.00 -0.01 0.04 -0.04 0.16 0.09 0.20 -0.02 0.01 -0.19 0.01 -0.60 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.01 -0.02 -0.03 -0.16 0.01 -0.01 0.05 0.11 -0.10 0.17 0.10 0.52 0.02 0.00 0.02 -0.05 -0.10 0.09 -0.03 0.12 0.07 -0.17 -0.02 -0.37 -0.00 0.01 -0.04 0.04 -0.15 -0.08 -0.18 0.01 -0.01 0.18 -0.02 0.57 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.01 -0.02 -0.08 0.01 -0.00 0.02 0.05 -0.04 0.09 0.06 0.29 -0.04 -0.00 -0.04 0.09 0.18 -0.16 0.06 -0.22 -0.11 0.37 0.04 0.72 -0.00 0.01 -0.02 0.01 -0.06 -0.03 -0.08 0.00 -0.00 0.08 -0.02 0.29 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.05 0.03 -0.06 0.67 -0.03 0.00 -0.23 -0.43 0.35 0.10 0.06 0.31 0.00 0.00 -0.00 -0.01 -0.01 0.01 -0.00 0.01 0.00 -0.00 -0.00 -0.01 -0.02 -0.01 -0.01 -0.04 0.15 0.07 0.20 -0.02 0.00 0.02 -0.01 0.08 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.01 -0.01 0.02 -0.19 0.01 -0.00 0.07 0.12 -0.10 -0.04 -0.02 -0.11 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.01 0.01 0.01 -0.00 0.00 -0.01 -0.05 -0.04 -0.05 -0.16 0.51 0.25 0.66 -0.07 0.01 0.10 -0.01 0.33 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.01 -0.00 0.00 -0.00 -0.01 0.00 -0.01 -0.00 -0.01 0.02 -0.01 -0.08 -0.24 -0.49 0.37 -0.15 0.57 0.26 0.18 0.02 0.34 0.00 -0.00 0.00 0.00 0.01 0.00 -0.01 0.00 0.00 -0.01 -0.00 -0.01 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.06 -0.03 0.03 0.51 -0.03 0.01 0.20 0.40 -0.33 -0.01 -0.01 0.00 0.00 0.01 -0.00 -0.03 -0.06 0.05 0.02 -0.07 -0.03 0.00 0.00 0.00 0.05 -0.04 -0.02 -0.11 0.41 0.21 -0.42 0.04 -0.01 0.01 -0.01 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.05 -0.03 0.02 0.43 -0.03 0.01 0.18 0.34 -0.29 -0.01 -0.01 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.02 0.01 0.01 0.00 0.01 -0.05 0.04 0.02 0.14 -0.49 -0.25 0.50 -0.04 0.02 -0.01 0.01 -0.01 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.01 -0.00 0.00 0.06 -0.00 0.00 0.02 0.04 -0.03 0.00 0.00 0.01 -0.01 -0.09 0.01 0.25 0.50 -0.40 -0.17 0.62 0.30 -0.00 -0.02 0.00 0.01 -0.00 -0.00 -0.01 0.05 0.02 -0.06 0.01 -0.00 -0.00 -0.00 -0.01 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.01 -0.00 -0.05 -0.06 0.02 0.00 0.00 -0.00 -0.02 0.00 0.01 0.05 -0.13 -0.01 0.54 0.74 -0.21 0.01 -0.02 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.01 -0.00 -0.00 -0.14 0.27 0.02 -0.02 -0.04 0.01 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.02 0.02 -0.01 -0.00 -0.00 0.00 0.01 -0.00 -0.00 -0.02 0.04 0.00 -0.18 -0.24 0.07 0.04 -0.07 -0.01 0.00 0.01 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.02 -0.00 -0.01 -0.42 0.83 0.06 -0.07 -0.12 0.04 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.01 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.06 0.00 0.02 0.01 -0.04 -0.00 -0.00 -0.01 0.00 -0.01 0.01 0.00 0.03 0.04 -0.01 -0.06 0.01 0.02 -0.00 -0.00 0.00 0.74 -0.10 -0.25 0.05 -0.09 -0.01 -0.30 -0.49 0.16 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.07 0.01 0.02 0.02 -0.04 -0.01 -0.01 -0.01 0.00 0.00 0.00 -0.00 0.76 -0.07 -0.26 -0.22 0.53 0.05 0.06 0.07 -0.02 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.05 -0.01 -0.02 0.00 -0.01 -0.00 -0.02 -0.04 0.01 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.01 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.05 0.00 0.02 -0.03 0.08 0.01 0.01 0.01 -0.00 0.01 -0.01 -0.00 -0.03 -0.06 0.02 -0.05 0.01 0.02 0.00 0.00 -0.00 0.57 -0.08 -0.19 -0.05 0.09 0.01 0.39 0.64 -0.20 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.05 -0.00 -0.02 0.02 -0.07 -0.01 -0.01 -0.01 0.00 0.00 0.00 -0.00 -0.55 0.04 0.19 -0.29 0.74 0.07 0.06 0.08 -0.02 -0.00 0.00 0.00 0.00 0.01 -0.00 0.01 -0.00 -0.00 0.00 -0.00 0.00 -0.06 0.01 0.02 0.00 -0.01 -0.00 -0.04 -0.06 0.02 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.05 -0.04 -0.01 -0.05 -0.03 0.02 -0.50 0.52 0.09 0.54 0.39 -0.17 0.00 -0.00 -0.00 -0.00 0.01 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 -0.04 0.05 0.01 -0.05 -0.04 0.02 0.47 -0.49 -0.08 0.56 0.42 -0.18 0.00 0.00 -0.00 0.00 -0.02 0.00 0.00 -0.00 -0.00 0.00 0.02 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.01 0.01 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.01 -0.01 -0.00 0.00 -0.00 0.00 0.02 -0.07 -0.00 -0.24 0.86 0.01 -0.02 -0.03 0.01 0.18 0.40 -0.09 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 0.00 0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 -0.00 -0.01 0.01 0.00 -0.01 -0.01 0.00 -0.01 0.03 0.00 0.12 -0.42 -0.01 -0.03 -0.06 0.01 0.37 0.80 -0.18 -0.00 -0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 -0.00 0.00 -0.00 -0.00 -0.00 -0.00 0.00 -0.00 0.00 -0.00 -0.00 -0.00 0.00 0.00 -0.00 0.00 -0.00 0.00 -0.00 0.00 6 8 5 6 6 6 6 6 6 6 7 1 1 1 6 6 6 7 1 1 1 6 6 6 1 1 7 1 7 1 7 6 1 1 1 6 1 1 1 6 1 1 1 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 6 8 5 6 6 6 6 6 6 6 7 1 1 1 6 6 6 7 1 1 1 6 6 6 1 1 7 1 7 1 7 6 1 1 1 6 1 1 1 6 1 1 1 12.00000 15.99491 11.00931 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 1.00783 1.00783 12.00000 12.00000 12.00000 14.00307 1.00783 1.00783 1.00783 12.00000 12.00000 12.00000 1.00783 1.00783 14.00307 1.00783 14.00307 1.00783 14.00307 12.00000 1.00783 1.00783 1.00783 12.00000 1.00783 1.00783 1.00783 12.00000 1.00783 1.00783 1.00783 320.16827 6769.75288 7471.94295 9650.69811 0.98323 0.07223 0.16749 -0.08738 0.99255 0.08491 -0.16011 -0.09812 0.98221 asymmetric 1 0.01279 0.01159 0.00897 0.26659 0.24154 0.18701 919302.2 32.64 42.61 48.28 78.78 86.16 107.37 108.71 138.37 149.55 164.68 225.31 234.54 299.29 319.23 343.30 352.50 376.69 379.04 415.63 429.60 472.83 510.42 539.56 547.58 607.94 616.27 622.55 623.49 687.47 743.28 834.77 840.04 908.42 917.74 957.08 1004.79 1048.56 1069.89 1090.76 1117.71 1129.66 1162.19 1196.48 1245.58 1254.80 1276.20 1281.34 1303.49 1307.53 1352.73 1381.25 1391.79 1439.88 1441.52 1477.20 1493.26 1499.11 1547.66 1548.19 1549.87 1561.88 1569.39 1572.46 1599.68 1608.72 1613.82 1618.42 1627.44 1680.74 1711.02 1731.01 1741.80 1784.50 1839.50 1858.23 1881.25 1886.55 1929.81 1932.82 1937.83 1947.44 1972.91 2065.83 2066.17 2074.10 2101.00 2102.24 2102.50 2114.52 2117.71 2123.33 2137.47 2142.88 2154.45 2159.52 2164.24 2204.01 2243.43 2328.28 2340.12 2358.86 2391.86 2395.42 2532.15 4265.54 4273.86 4296.20 4434.22 4434.56 4446.75 4506.24 4508.63 4518.64 4562.83 4563.18 4631.57 4632.96 4651.31 4653.02 4755.25 4782.98 4901.48 4913.69 0.350144 0.371763 0.372708 0.296985 -1031.685726 -1031.664106 -1031.663162 -1031.738885 233.285 81.476 159.373 0.000 0.000 1.377 0.889 2.981 43.187 0.889 2.981 34.545 231.508 75.515 80.264 1 0.593 1.985 6.384 2 0.593 1.984 5.855 3 0.594 1.983 5.607 4 0.596 1.976 4.638 5 0.597 1.973 4.461 6 0.599 1.966 4.028 7 0.599 1.965 4.003 8 0.603 1.952 3.531 9 0.605 1.946 3.379 10 0.607 1.937 3.192 11 0.620 1.895 2.591 12 0.623 1.888 2.515 13 0.641 1.828 2.061 14 0.648 1.808 1.944 15 0.657 1.781 1.813 16 0.660 1.771 1.766 17 0.669 1.743 1.650 18 0.670 1.740 1.639 19 0.685 1.694 1.481 20 0.692 1.676 1.425 21 0.712 1.618 1.267 22 0.731 1.565 1.145 23 0.746 1.523 1.059 24 0.750 1.512 1.037 25 0.785 1.421 0.883 26 0.790 1.409 0.864 27 0.794 1.399 0.850 28 0.794 1.398 0.848 29 0.834 1.299 0.716 30 0.872 1.213 0.618 31 0.937 1.074 0.485 32 0.941 1.066 0.478 0.282818e+25 24.451507 56.301675 0.794012e+09 8.899827 20.492610 0.200000e+01 0.301030 0.693147 0.225176e+09 8.352521 19.232391 0.790912e+07 6.898128 15.883527 coments ./ancestor::cml:module[@dictRef='cc:finalization']/cml:molecule[@id='mol9999'] 5.7279 -0.6667 -2.4730 6.2744 -132.3254 -119.0077 -146.1681 -0.1211 -11.7952 -1.8715 0.1750 13.4927 -13.6677 -0.1211 -11.7952 -1.8715 117.6272 -1.0032 -14.4688 -12.9038 -16.7788 -46.2297 -1.3839 -2.5137 -2.0898 4.4867 -3679.6599 -3056.5013 -2089.1543 36.8253 -13.5030 5.6891 33.9235 66.6491 58.8584 -1059.2105 -935.3237 -908.8092 11.6290 -6.0357 9.5863 0 -1032.0358693 0.779758 0. 0.750743 3.375E-9 5.707E-6 0.3501437 0.3717634 -1031.6641059 -1031.6631617 -1031.7388847 0.1301393,10.0314576,-10.1615969,-0.0900137,-8.7694376,-1.3914425 C01 [X(C17H19B1N5O1)] 2.25352 -0.262281 -0.9729343 1.7067054 -0.0961152 -0.3946122 -0.1004576 0.9440702 -0.02742 -0.4420439 -0.0233531 0.3736235 -1.7275377 0.1257908 0.3826264 0.1319705 -0.5535876 -0.0205529 0.4443312 -0.0252092 -0.4635636 -0.4873628 0.0308111 0.1426324 0.0340952 -0.2469647 0.0058855 0.168688 0.0045571 -0.0777871 -0.47296 -0.491528 0.1677487 0.6251196 -0.5529547 -0.1632156 0.0844755 0.226239 -0.0932494 -0.4897425 0.5088838 0.0970697 -0.6088154 -0.5341199 0.2333108 0.179028 -0.1561609 -0.0946349 0.1832711 -0.5014887 -0.0151157 -0.3841126 0.6967025 0.080111 -0.0496525 0.1339795 -0.0029726 0.3197937 0.5372681 -0.1405857 0.4154358 0.4944225 -0.1823985 -0.1587683 -0.2325195 0.0607398 0.1820014 -0.1014675 -0.0561383 0.328093 0.4593398 -0.1594235 -0.091646 0.0135619 -0.001384 -0.5215906 -0.2231787 0.1380471 -0.2163832 -0.2577275 0.0975099 0.1389075 0.0845881 -0.1878537 0.6093556 0.105148 -0.1916001 -0.2646909 0.4711643 0.0218122 -0.1846763 -0.058595 0.101311 -0.4564484 -0.0068114 0.03044 0.4342931 -0.9269086 -0.065454 0.0278751 0.0538282 -0.3257369 0.0227547 0.04008 0.0218548 -0.0384915 0.132806 0.0090432 0.0300893 -0.017031 0.0892803 0.061961 0.0499116 0.0166474 0.0525903 -0.0727162 -0.0032924 0.020778 -0.0103136 0.1186667 0.0266306 -0.1108711 0.0292577 -0.0492481 -0.0882206 0.0327425 0.0216513 0.0423911 0.0745325 0.624006 -0.164641 -0.171925 0.2007163 0.4556169 -0.067003 -0.2251582 0.0168229 0.1029997 -0.4490259 0.2709546 0.0750823 0.2639141 -0.3644504 -0.0858163 0.0786759 -0.0731166 -0.1530419 0.1538162 0.1357965 -0.0624118 -0.293697 0.5000608 0.0705983 -0.0381681 -0.1017999 -0.0132922 -0.5271995 -0.0421324 0.0510487 -0.4776347 -0.8329746 0.1680634 0.1180054 0.0441374 -0.3496199 0.0254609 -0.019496 0.0255496 0.0589232 0.1280682 -0.0206686 0.0219461 0.0049195 0.0900047 0.0479571 0.0928075 0.0064338 0.0313634 -0.1179904 0.0012209 0.0096791 -0.0078331 0.0829872 0.0448621 -0.0617315 0.0307518 -0.0637943 -0.0464254 0.0346503 0.0362729 0.0407661 0.1095083 1.4128914 -0.126055 -0.3903214 -0.1256913 0.241568 0.0303164 -0.3847652 0.0293918 0.2396754 -0.1368137 0.2011011 -0.0010697 -0.2097838 0.1129668 0.0480726 0.0229916 -0.0647615 -0.0940786 -0.1296741 -0.1632452 0.0249196 0.2467277 0.1008736 -0.0901068 -0.0158273 0.024266 -0.0890603 0.0729016 0.0135309 0.0255326 0.0205133 0.0792289 0.0021012 0.0212715 0.0047958 0.1646934 0.0690592 -0.0064693 0.0280616 -0.014336 0.0843254 0.0103246 0.0247855 0.0080657 0.1635713 -0.4983532 0.2100947 0.0901469 -0.5521477 -0.4799958 0.1862788 0.1554957 -0.0214195 -0.249398 0.3730405 -0.1236595 -0.0442169 -0.0963043 0.394935 0.0057829 -0.0494533 0.008795 0.2872254 -0.4455454 -0.1965487 0.1060633 0.5651833 -0.5585448 -0.1445289 0.0496321 0.062578 -0.2236581 0.4026704 0.1101469 -0.068676 0.0823311 0.3584186 -0.0144996 -0.0688113 -0.0169349 0.2920473 -0.5466716 -0.0071357 -0.0833443 -0.0094314 -0.5267679 -0.0127908 -0.1085049 -0.0110936 -0.7122773 0.1997626 -0.112652 0.0620544 -0.056864 0.3856248 0.1378909 0.1365071 0.0767571 0.41458 -0.1602512 0.0609747 -0.023601 -0.0107076 0.035188 -0.0216351 0.0084515 -0.0292166 0.0450812 0.0465144 -0.0780804 0.0621217 -0.0150717 -0.0769335 0.0605345 0.0168868 0.0761029 -0.0303275 -0.0148667 0.0014499 -0.0708721 0.0383887 -0.0476817 0.0161695 -0.0419825 -0.0916232 -0.1783108 0.4812708 -0.0187531 0.1025365 -0.0256831 0.0954452 0.0229051 0.0362381 0.0283516 0.397763 -0.0095762 -0.0274535 0.0277532 -0.0722619 -0.0353631 0.1164494 0.0289835 0.0659968 -0.0132951 0.0049867 0.0219817 0.0058682 0.0667911 -0.0849436 -0.1061624 0.0053668 -0.0555297 0.0220208 -0.1011286 0.0077328 -0.0074211 -0.0035054 0.0168509 -0.0184691 -0.1276521 -0.0098426 -0.172893 0.2312499 0.1410056 0.0162338 0.1015833 0.3119346 -0.1260229 0.1085306 -0.0773146 0.4560592 0.0583815 0.0658442 0.0390743 -0.0051799 -0.1144365 -0.0524102 0.0054356 -0.0616966 -0.0044653 -0.1633708 -0.0336184 -0.0106047 0.0431079 0.0487236 0.0235106 0.0074746 0.0274513 0.0349667 -0.0231859 -0.0181824 -0.0730404 -0.0468475 -0.0286271 -0.0334138 -0.0213444 0.0670218 -0.1904373 296.8601325|-4.348394|303.7781685|-49.7286162|-12.1248139|145.6084639 0.000033506 -0.000001283 -0.000002021 -0.000010145 -0.000001503 -0.000000886 -0.000003122 -0.000005205 -0.000009175 -0.000010317 0.000009234 0.000000779 -0.000012294 -0.000006874 0.000000710 0.000002061 -0.000002242 0.000003332 0.000004926 -0.000002150 -0.000009604 -0.000000972 0.000000699 0.000000225 -0.000004731 -0.000001319 0.000002085 -0.000001191 -0.000000062 -0.000006786 -0.000002652 0.000002956 0.000010634 -0.000000897 -0.000001398 0.000000231 -0.000002101 -0.000000559 0.000000083 -0.000000511 0.000000271 0.000001118 -0.000001990 -0.000002474 0.000002221 0.000003811 -0.000002203 -0.000000961 0.000000284 0.000003740 0.000001775 -0.000001000 0.000009693 0.000001554 -0.000000043 -0.000000921 -0.000000450 0.000002161 0.000000696 -0.000000725 0.000000697 -0.000000289 0.000000216 0.000007291 -0.000000343 0.000011238 -0.000003206 -0.000001017 -0.000009051 -0.000002797 0.000007419 0.000001960 0.000000799 0.000001178 0.000005695 -0.000001868 0.000001911 -0.000003643 0.000001166 -0.000000557 -0.000001864 0.000001968 0.000002252 0.000003619 -0.000006102 -0.000004879 0.000004383 0.000003534 0.000002048 0.000002493 0.000007898 -0.000004979 0.000009397 -0.000004428 -0.000009276 -0.000004207 0.000000895 0.000000240 0.000002219 -0.000002452 -0.000000141 -0.000001505 0.000007983 0.000008622 -0.000005042 -0.000005851 -0.000002026 0.000000725 0.000001386 0.000000273 0.000002108 -0.000002110 -0.000000673 -0.000000592 -0.000000910 0.000000306 -0.000000056 -0.000005197 0.000019108 -0.000004705 0.000000013 -0.000000562 0.000001115 -0.000000448 0.000000768 0.000000353 0.000006955 -0.000018479 -0.000008995 301.02579999999995 AuxInfo=1/0/N:9,16,8,17,10,15,23,24,5,4,1,6,7,22,3,11,18,29,27,2;32,36,40,31/E:(1,2)(3,4)(5,6)(7,8)(9,10)(12,13)(16,17)(18,19);(1,2,3)/CRV:1.3,2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,16.2,17.2,20.1;/rA:43nC3O1BC3C3C3C3C3C3C3N2HHHC3C3C3N2HHHC3C3C3HHNHNHNCHHHCHHHCHHH/rB:s1;;s1;s1;s3s5;s3s4;s5;s8;s9;s6s10;s8;s9;s10;;s15;s4s16;s7s15;s17;s15;s16;s3;;s23;s23;s24;s22s24;s27;s22s23;s29;;s31;s32;s32;s32;s31;s36;s36;s36;s31;s40;s40;s40;/rC:-2.5872,.2047,.04;-3.7432,.328,.4216;.1966,-.0946,-.9026;-1.9609,-1.1444,-.063;-1.7729,1.4018,-.3161;-.4366,1.2941,-.7739;-.6298,-1.324,-.5134;-2.3439,2.6722,-.1777;-1.5847,3.7896,-.4871;-.2662,3.5972,-.9274;.2955,2.4085,-1.0703;-3.3748,2.7472,.1757;-1.9886,4.7987,-.3915;.3565,4.4653,-1.1727;-.7987,-3.6123,-.2107;-2.1248,-3.5209,.2393;-2.7088,-2.2662,.3129;-.0719,-2.5692,-.5751;-3.7345,-2.1197,.6589;-.3126,-4.5929,-.2721;-2.6699,-4.422,.5244;1.6637,-.2454,-1.3316;3.6629,-1.1253,-1.7846;3.7624,.2302,-1.9194;4.4089,-1.902,-1.9181;4.611,.8495,-2.1914;2.5201,.7463,-1.6387;2.158,1.7105,-1.6;2.3631,-1.3912,-1.4261;1.8662,-2.2665,-1.2047;1.5307,.191,2.9456;1.9476,-1.1007,2.4544;3.0466,-1.175,2.4726;1.5476,-1.8974,3.1009;1.6068,-1.3121,1.417;.0937,.3086,3.0393;-.3111,-.4935,3.6755;-.1781,1.2716,3.4986;-.4173,.2484,2.054;2.1274,1.2843,2.2163;1.86,2.243,2.6877;3.2254,1.1966,2.2355;1.806,1.3361,1.1527; Gaussian 16 17-Dec-2024 Gaussian 16 7-Dec-2021 ES64L-G16RevC.02 UwB97XD def2TZVPP SP #p wB97xD/def2TZVPP guess=read geom=allcheck SCF=(XQC) gfprintgfinput nosymm 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 301.02579999999995 AuxInfo=1/0/N:9,16,8,17,10,15,23,24,5,4,1,6,7,22,3,11,18,29,27,2;32,36,40,31/E:(1,2)(3,4)(5,6)(7,8)(9,10)(12,13)(16,17)(18,19);(1,2,3)/CRV:1.3,2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,13.3,14.3,16.2,17.2,20.1;/rA:43nC3O1BC3C3C3C3C3C3C3N2HHHC3C3C3N2HHHC3C3C3HHNHNHNCHHHCHHHCHHH/rB:s1;;s1;s1;s3s5;s3s4;s5;s8;s9;s6s10;s8;s9;s10;;s15;s4s16;s7s15;s17;s15;s16;s3;;s23;s23;s24;s22s24;s27;s22s23;s29;;s31;s32;s32;s32;s31;s36;s36;s36;s31;s40;s40;s40;/rC:-2.5872,.2047,.04;-3.7432,.328,.4216;.1966,-.0946,-.9026;-1.9609,-1.1444,-.063;-1.7729,1.4018,-.3161;-.4366,1.2941,-.7739;-.6298,-1.324,-.5134;-2.3439,2.6722,-.1777;-1.5847,3.7896,-.4871;-.2662,3.5972,-.9274;.2955,2.4085,-1.0703;-3.3748,2.7472,.1757;-1.9886,4.7987,-.3915;.3565,4.4653,-1.1727;-.7987,-3.6123,-.2107;-2.1248,-3.5209,.2393;-2.7088,-2.2662,.3129;-.0719,-2.5692,-.5751;-3.7345,-2.1197,.6589;-.3126,-4.5929,-.2721;-2.6699,-4.422,.5244;1.6637,-.2454,-1.3316;3.6629,-1.1253,-1.7846;3.7624,.2302,-1.9194;4.4089,-1.902,-1.9181;4.611,.8495,-2.1914;2.5201,.7463,-1.6387;2.158,1.7105,-1.6;2.3631,-1.3912,-1.4261;1.8662,-2.2665,-1.2047;1.5307,.191,2.9456;1.9476,-1.1007,2.4544;3.0466,-1.175,2.4726;1.5476,-1.8974,3.1009;1.6068,-1.3121,1.417;.0937,.3086,3.0393;-.3111,-.4935,3.6755;-.1781,1.2716,3.4986;-.4173,.2484,2.054;2.1274,1.2843,2.2163;1.86,2.243,2.6877;3.2254,1.1966,2.2355;1.806,1.3361,1.1527; chk=18_a_TMA_2.chk Mem=12000MB NProc=12 #p wB97xD/def2TZVPP guess=read geom=allcheck SCF=(XQC) gfprint gfinput 1/29=7,38=1,172=1/1 2/12=2,15=1,40=1/2 3/5=44,7=202,11=2,14=-4,24=110,25=1,30=1,74=-58,116=-2/1,2,3 4/5=1/1 5/5=2,8=3,13=1,38=6/2,8 6/7=2,8=2,9=2,10=2,28=1/1 99/5=1,9=1/99 coments Redundant internal coordinates found in file. (old form). 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 12 16 11 12 12 12 12 12 12 12 14 1 1 1 12 12 12 14 1 1 1 12 12 12 1 1 14 1 14 1 14 12 1 1 1 12 1 1 1 12 1 1 1 12.0000000 15.9949146 11.0093053 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 14.0030740 1.0078250 1.0078250 1.0078250 12.0000000 12.0000000 12.0000000 14.0030740 1.0078250 1.0078250 1.0078250 12.0000000 12.0000000 12.0000000 1.0078250 1.0078250 14.0030740 1.0078250 14.0030740 1.0078250 14.0030740 12.0000000 1.0078250 1.0078250 1.0078250 12.0000000 1.0078250 1.0078250 1.0078250 12.0000000 1.0078250 1.0078250 1.0078250 0 0 3 0 0 0 0 0 0 0 2 1 1 1 0 0 0 2 1 1 1 0 0 0 1 1 2 1 2 1 2 0 1 1 1 0 1 1 1 0 1 1 1 3.6000000 5.6000000 2.7500000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 3.6000000 4.5500000 1.0000000 1.0000000 1.0000000 3.6000000 3.6000000 3.6000000 4.5500000 1.0000000 1.0000000 1.0000000 3.6000000 3.6000000 3.6000000 1.0000000 1.0000000 4.5500000 1.0000000 4.5500000 1.0000000 4.5500000 3.6000000 1.0000000 1.0000000 1.0000000 3.6000000 1.0000000 1.0000000 1.0000000 3.6000000 1.0000000 1.0000000 1.0000000 (Enter /NFS_R1/Userdata/grufor/SOFTWARE/g16/l101.exe) Structure from the checkpoint file: "18_a_TMA_2.chk" def2TZVPP (5D, 7F) 0.10000e-02 0.10000e-05 F 43 43 43 1.00e+00 60 F IExCor= 4639 DFT=T Ex+Corr=wB97XD ExCW=0 ScaHFX= 1.000000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 IRadAn= 5 IRanWt= -1 IRanGd= 0 ICorTp=0 IEmpDi=121 Grimme-D2 -0.0370026415 0.000000 1.223580 0.000000 2.954214 4.177768 0.000000 1.490944 2.362019 2.542011 0.000000 1.490951 2.362070 2.542071 2.565676 0.000000 2.544424 3.646373 1.531611 2.962264 1.416653 0.000000 2.544494 3.646396 1.531606 1.416669 2.962375 2.638060 0.000000 2.488990 2.795102 3.825530 3.837482 1.399657 2.427455 4.361229 0.000000 3.759522 4.179418 4.293286 4.966433 2.401245 2.761876 5.202016 1.385872 0.000000 4.222755 4.959539 3.720749 5.108999 2.731929 2.314513 4.951922 2.394684 1.403325 0.000000 3.794645 4.781793 2.510594 4.327701 2.420871 1.365923 3.885545 2.798761 2.404787 1.322535 0.000000 2.665132 2.459461 4.689656 4.147342 2.148904 3.412632 4.958234 1.092312 2.174880 3.406224 3.890808 0.000000 4.652878 4.871084 5.383319 5.952231 3.404539 3.851902 6.272813 2.166563 1.091120 2.167303 3.375068 2.540073 0.000000 5.318727 6.038805 4.570712 6.170171 3.827958 3.293179 5.909629 3.390818 2.166802 1.096189 2.060339 4.323481 2.494115 0.000000 4.222737 4.959423 3.720736 2.731917 5.109031 4.951881 2.314462 6.471812 7.448665 7.264609 6.179495 6.872355 8.496708 8.216375 0.000000 3.759454 4.179228 4.293252 2.401217 4.966412 5.201928 2.761840 6.210960 7.366266 7.448637 6.536802 6.391806 8.344558 8.481153 1.403350 0.000000 2.488932 2.794922 3.825508 1.399671 3.837461 4.361138 2.427481 4.976127 6.210972 6.471790 5.726406 5.059324 7.136387 7.544326 2.394716 1.385861 0.000000 3.794702 4.781781 2.510629 2.420905 4.327807 3.885570 1.365917 5.726488 6.536883 6.179542 5.015738 6.303733 7.615358 7.072903 1.322516 2.404807 2.798827 0.000000 2.664963 2.459127 4.689581 2.148880 4.147197 4.958049 3.412641 5.059205 6.391704 6.872228 6.303557 4.904013 7.212173 7.965740 3.406310 2.174955 1.092328 3.890888 0.000000 5.318717 6.038679 4.570756 3.827953 6.170232 5.909642 3.293156 7.544369 8.481212 8.216422 7.072916 7.965875 9.540746 9.127478 1.096196 2.166801 3.390829 2.060346 4.323555 0.000000 4.652795 4.870862 5.383281 3.404508 5.952197 6.272719 3.851859 7.136367 8.344553 8.496678 7.615277 7.212267 9.291149 9.540690 2.167317 1.091114 2.166537 3.375071 2.540163 2.494089 0.000000 4.489315 5.712874 1.535988 3.944056 3.943965 2.663116 2.663296 5.089668 5.248438 4.318929 2.997137 6.050910 6.298029 4.891285 4.319305 5.248746 5.089885 2.997518 6.051052 4.891778 6.298357 0.000000 6.645421 7.863165 3.722322 5.881465 6.171785 4.866287 4.481386 7.285941 7.305945 6.202785 4.933215 8.268469 8.305003 6.523939 5.344932 6.582716 6.804374 4.182906 7.853672 5.487833 7.503588 2.230752 0.000000 6.645051 7.862772 3.722126 6.171845 5.880709 4.480563 4.866567 6.803220 6.581196 5.343257 4.181478 7.852609 7.501923 5.485813 6.203845 7.306756 7.286345 4.934118 8.268709 6.525390 8.305944 2.230695 1.365768 0.000000 7.564284 8.769514 4.694907 6.677629 7.190080 5.916376 5.262749 8.339881 8.388432 7.285585 6.018210 9.305120 9.389233 7.584253 5.741084 7.068581 7.468079 4.725156 8.544198 5.678296 7.901014 3.259577 1.085218 2.228044 0.000000 7.563660 8.768835 4.694626 7.189988 6.676562 5.261701 5.916574 7.466494 7.066540 5.738912 4.723412 8.542670 7.898749 5.675668 7.286680 8.389218 8.340168 6.019117 9.305198 7.585825 9.390179 3.259524 2.228015 1.085225 2.772365 0.000000 5.403292 6.606696 2.578304 5.112438 4.539697 3.128891 3.933736 5.431586 5.238036 4.049314 2.834498 6.484196 6.189106 4.327750 5.661381 6.581064 6.342325 4.340802 7.253410 6.196678 7.637173 1.345768 2.197768 1.374211 3.264874 2.165202 0.000000 5.241545 6.389236 2.755339 5.241979 4.146782 2.754608 4.261538 4.818207 4.423690 3.144650 2.058269 5.902483 5.309542 3.319205 6.245381 7.006598 6.569555 4.933469 7.381991 6.899282 8.088849 2.035125 3.215663 2.206217 4.268266 2.666161 1.030663 0.000000 5.403891 6.607316 2.578622 4.540518 5.112745 3.933792 3.129729 6.342421 6.580880 5.660969 4.340405 7.253670 7.636929 6.195987 4.050614 5.239281 5.432666 2.835711 6.485223 4.329165 6.190399 1.345795 1.374293 2.197774 2.165272 3.264886 2.153825 3.113378 0.000000 5.243012 6.390753 2.756143 4.148461 5.243072 4.262210 2.756178 6.570469 7.007157 6.245584 4.933605 7.383147 8.089365 6.899146 3.146589 4.425679 4.820145 2.060201 5.904413 3.320987 5.311506 2.035248 2.206062 3.215521 2.665952 4.268110 3.113363 4.007254 1.030548 0.000000 5.039810 5.848387 4.082832 4.798541 4.797822 4.349874 4.350516 5.560985 5.868487 5.461831 4.750811 6.186318 6.689746 6.050561 5.463786 5.870607 5.562547 4.752089 6.187871 6.052800 6.692289 4.301429 5.352851 5.352513 6.026555 6.025820 4.722547 4.833705 4.723102 4.834874 0.000000 5.300758 6.209593 3.917616 4.649298 5.270776 4.673452 3.937101 6.291283 6.711507 6.197409 5.240894 6.951736 7.641679 6.831401 4.577502 5.229592 5.256119 3.926003 6.045515 4.973754 6.006487 3.891818 4.572965 4.918790 5.081222 5.699168 4.526855 4.938144 3.913513 3.841186 1.443355 0.000000 6.289803 7.250382 4.547774 5.613034 6.135619 5.363694 4.738649 7.133294 7.406520 6.731229 5.741273 7.867299 8.321157 7.234556 5.284650 6.102023 6.243424 4.578034 7.082758 5.522693 6.856944 4.153214 4.301893 4.666533 4.654305 5.319698 4.568540 5.069739 3.964122 4.013396 2.094638 1.101692 0.000000 5.557383 6.334328 4.593803 4.784019 5.795430 5.397803 4.258252 6.839203 7.417996 7.050378 6.124283 7.372854 8.339002 7.756718 4.405972 4.930592 5.101544 4.072755 5.823471 4.701391 5.549711 4.731784 5.379450 5.885125 5.777289 6.703598 5.513463 5.957169 4.627624 4.333066 2.094179 1.101234 1.778679 0.000000 4.667583 5.683585 2.975123 3.866141 4.668155 3.970816 2.954454 5.833177 6.311749 5.753737 4.663519 6.544819 7.317023 6.453551 3.704975 4.493367 4.555615 2.892595 5.454888 4.159430 5.362693 2.948896 3.809538 4.261028 4.395752 5.168968 3.795806 4.306053 2.943042 2.802017 2.145088 1.112262 1.790639 1.783702 0.000000 4.024158 4.644865 3.963788 3.994612 3.992307 3.974007 3.976224 4.677386 5.231597 5.165204 4.619422 5.116376 6.022217 5.923552 5.170375 5.237046 4.681559 4.623177 5.120313 5.929224 6.028384 4.677278 6.169726 6.168798 6.934261 6.932493 5.287968 5.267827 5.289603 5.271114 1.444890 2.401102 3.352953 2.642767 2.747389 0.000000 4.345630 4.800180 4.623329 4.137789 4.654250 4.796632 4.282214 5.385267 6.106851 6.158121 5.595687 5.668910 6.881969 6.967107 5.006675 4.925570 4.494209 4.736379 4.843862 5.691072 5.561134 5.388164 6.782639 6.958397 7.453217 7.775052 6.147595 6.227744 5.829533 5.630272 2.096109 2.638477 3.631247 2.399157 3.073951 1.100898 0.000000 4.347837 4.802966 4.623484 4.658317 4.136734 4.280309 4.799619 4.490877 4.919811 5.000584 4.731962 4.841283 5.554399 5.683907 6.164090 6.113890 5.391542 5.599811 5.675548 6.973379 6.889983 5.387373 6.957704 6.779797 7.775087 7.449128 5.826418 5.625420 6.148210 6.230362 2.096065 3.352045 4.175759 3.630198 3.767472 1.100899 1.778889 0.000000 2.960885 3.705826 3.039075 2.967237 2.964122 3.015112 3.018126 3.816764 4.512230 4.486249 3.864648 4.303379 5.399529 5.365930 4.492186 4.518427 3.821763 3.869223 4.307877 5.372178 5.406212 4.004615 5.768010 5.766959 6.610165 6.608247 4.744698 4.703387 4.746622 4.707265 2.143078 2.751911 3.768300 3.092099 2.633969 1.111520 1.786245 1.786252 0.000000 5.303666 6.212835 3.918742 5.273303 4.651826 3.938932 4.675052 5.258355 5.231097 4.578418 3.926980 6.047962 6.007711 4.973974 6.199109 6.714072 6.294234 5.242007 6.955094 6.832784 7.644496 3.891338 4.916405 4.570361 5.696564 5.077956 3.912089 3.840157 4.525613 4.937544 1.443330 2.403532 2.637961 3.352865 2.766045 2.401074 3.352019 2.638075 2.752201 0.000000 5.562541 6.340193 4.595732 5.799948 4.788366 4.261098 5.400794 5.105654 4.933264 4.407240 4.073984 5.828118 5.551975 4.701279 7.053600 7.422551 6.844386 6.126603 7.378744 7.759461 8.343945 4.731271 5.881903 5.375442 6.700044 5.771982 4.625256 4.330890 5.512145 5.956977 2.094182 3.352875 3.624465 4.172615 3.783774 2.642915 3.630098 2.398908 3.092823 1.101240 0.000000 6.292084 7.253027 4.548447 6.136871 5.615729 4.740900 5.363970 6.246492 6.105186 5.287584 4.580516 7.085870 6.860150 5.525503 6.730743 7.407000 7.134564 5.740517 7.869103 7.233511 8.321732 4.152410 4.663020 4.299461 5.315453 4.651691 3.963517 4.014304 4.565947 5.067069 2.094622 2.637800 2.390103 3.624447 3.095688 3.352946 4.175765 3.631056 3.768432 1.101693 1.778683 0.000000 4.671050 5.687280 2.976800 4.671263 3.869243 2.956860 3.973042 4.558264 4.495107 3.705950 2.893703 5.457734 5.364091 4.159462 5.755886 6.314709 5.836566 4.665156 6.548522 6.455348 7.320148 2.948403 4.258395 3.806302 5.166212 4.391797 2.941003 2.800279 3.794585 4.305745 2.145086 2.766244 3.096241 3.783837 2.668749 2.747201 3.767502 3.073097 2.634123 1.112266 1.783662 1.790651 0.000000 0.2665889 0.2415357 0.1870063 NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 1135 1134 1135 1135 1135 MxSgAt= 43 MxSgA2= 43. 1 open 1 1 1 -1032.61744175358 -1032.87583804580 -0.258396292226 -1033.14269168371 -0.266853637907 -1033.14302027910 -0.000328595394 -1033.14307694859 -0.000056669487 -1033.14308981211 -0.000012863514 -1033.14309089114 -0.000001079036 -1033.14309126248 -0.000000371334 -1033.14309137721 -0.000000114729 -1033.14309143347 -0.000000056261 -1033.14309147039 -0.000000036920 -1033.14309148591 -0.000000015523 -1033.14309149054 -0.000000004635 -1033.14309149151 -0.000000000966 -1033.14309149184 -0.000000000326 -1033.14309149193 -0.000000000098 -1033.14309149195 -0.000000000015 -1033.14309149196 -0.000000000012 -1033.14309149 18 0.7787 1.027685688920e+03 -6.472863620537e+03 2.377900568655e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 1572864000 LenX= 1570201577 LenY= 1568880227 Requested convergence on RMS density matrix=1.00D-08 within 32 cycles. Requested convergence on MAX density matrix=1.00D-06. Requested convergence on energy=1.00D-06. No special actions if energy rises. Fock matrices will be formed incrementally for 20 cycles. 0.7787 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 C O B C C C C C C C N H H H C C C N H H H C C C H H N H N H N C H H H C H H H C H H H 13 17 11 13 13 13 13 13 13 13 14 1 1 1 13 13 13 14 1 1 1 13 13 13 1 1 14 1 14 1 14 13 1 1 1 13 1 1 1 13 1 1 1 -0.01225 0.01743 0.00674 0.00570 0.00570 -0.02279 -0.02280 -0.00871 0.00753 -0.00842 0.00914 0.00079 -0.00157 0.00078 -0.00841 0.00753 -0.00871 0.00913 0.00079 0.00078 -0.00157 -0.02407 -0.00224 -0.00225 -0.00037 -0.00036 0.01055 -0.00133 0.01055 -0.00133 0.00195 0.00057 0.00004 0.00007 0.00012 0.00009 0.00004 0.00004 0.00011 0.00056 0.00007 0.00003 0.00012 -13.77335 -10.56726 9.66505 6.40393 6.40571 -25.62239 -25.63168 -9.79471 8.46656 -9.46008 2.95184 3.51855 -7.03077 3.48974 -9.45671 8.46604 -9.79252 2.95097 3.51735 3.48753 -7.02794 -27.06363 -2.51881 -2.52646 -1.63299 -1.62797 3.40992 -5.94342 3.41025 -5.94352 0.62959 0.64560 0.15893 0.32472 0.53791 0.10216 0.18643 0.18506 0.49699 0.62488 0.32395 0.15592 0.54152 -4.91468 -3.77066 3.44873 2.28508 2.28572 -9.14270 -9.14602 -3.49500 3.02108 -3.37559 1.05329 1.25551 -2.50875 1.24523 -3.37439 3.02089 -3.49422 1.05298 1.25508 1.24444 -2.50774 -9.65697 -0.89878 -0.90150 -0.58269 -0.58090 1.21674 -2.12076 1.21686 -2.12080 0.22465 0.23037 0.05671 0.11587 0.19194 0.03645 0.06652 0.06603 0.17734 0.22297 0.11559 0.05563 0.19323 -4.59430 -3.52486 3.22391 2.13612 2.13671 -8.54671 -8.54981 -3.26716 2.82414 -3.15554 0.98463 1.17366 -2.34521 1.16405 -3.15442 2.82397 -3.26643 0.98434 1.17326 1.16332 -2.34427 -9.02745 -0.84019 -0.84274 -0.54471 -0.54303 1.13743 -1.98251 1.13754 -1.98255 0.21001 0.21535 0.05301 0.10831 0.17943 0.03408 0.06219 0.06173 0.16578 0.20844 0.10806 0.05201 0.18063 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 0.011152 -0.203515 -0.092085 -0.040789 -0.041493 0.009136 0.008640 0.018369 -0.042077 0.021906 -0.066312 -0.003167 -0.005453 0.000316 0.022833 -0.040816 0.018198 -0.065366 -0.002835 0.001205 -0.003625 0.009760 -0.006157 -0.006059 0.001084 0.001859 -0.075552 -0.002946 -0.075870 -0.001838 -0.001162 -0.001803 0.000371 -0.000678 -0.001210 -0.001426 -0.000892 -0.000900 -0.001447 -0.001604 -0.000577 0.000512 -0.000420 -0.006696 -0.285077 -0.129974 -0.061426 -0.061631 0.014442 0.015283 0.035758 -0.055557 0.034652 -0.083684 0.006317 0.006241 0.001832 0.031962 -0.055124 0.034801 -0.081644 0.005748 0.000511 0.003527 0.005164 -0.011581 -0.011815 0.000256 -0.000788 -0.098936 0.007035 -0.096384 0.005479 -0.002209 -0.002871 -0.001162 -0.000599 -0.001846 -0.002566 -0.001150 -0.000871 -0.004093 -0.002732 -0.000209 -0.001062 -0.001285 -0.004456 0.488592 0.222059 0.102215 0.103124 -0.023578 -0.023923 -0.054128 0.097634 -0.056559 0.149996 -0.003150 -0.000787 -0.002147 -0.054795 0.095940 -0.052999 0.147010 -0.002913 -0.001716 0.000098 -0.014923 0.017738 0.017874 -0.001339 -0.001071 0.174488 -0.004089 0.172254 -0.003641 0.003371 0.004674 0.000792 0.001277 0.003055 0.003992 0.002041 0.001771 0.005540 0.004335 0.000786 0.000550 0.001705 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 -0.001923 0.019622 0.008505 0.006764 0.001793 0.000978 -0.002442 -0.000896 -0.000048 -0.005210 0.003144 -0.000446 -0.005298 -0.003064 0.000851 0.008654 -0.002178 0.009650 0.001779 0.002894 0.006971 -0.001334 0.000073 0.000513 -0.002824 0.002413 0.006306 -0.003219 0.004204 0.004333 0.000110 -0.000380 -0.000465 -0.000232 -0.002287 0.000041 0.000026 -0.000017 -0.000278 0.000823 0.000440 0.000509 0.002958 -0.005932 0.261296 0.115220 0.058792 0.058986 -0.012152 -0.011742 -0.028406 0.054430 -0.029827 0.077648 0.000038 0.002104 -0.000795 -0.031070 0.054139 -0.028677 0.078043 -0.000274 -0.001551 0.000545 -0.009937 0.007327 0.007170 -0.000438 -0.001062 0.069877 -0.000423 0.070917 -0.001340 0.001897 0.003082 0.001395 0.000803 0.003948 0.001301 0.000096 0.000201 -0.000712 0.003041 0.000920 0.001388 0.003911 0.000679 0.058009 0.026741 0.014382 0.009720 -0.003720 -0.002266 -0.003937 0.006901 -0.002233 0.009951 -0.000324 0.001532 0.000830 -0.011042 0.015442 -0.009600 0.024729 -0.001487 -0.001275 -0.002787 -0.001270 0.002948 0.001902 0.000617 -0.000689 0.016437 0.000130 0.027471 -0.002040 0.000421 -0.000212 -0.000529 -0.001136 -0.003221 0.000566 -0.000379 0.000948 0.001035 0.001221 0.001291 0.000677 0.003410 0.0751 0.9928 -0.0931 0.3249 0.0639 0.9436 0.9428 -0.1012 -0.3178 -0.0069 -0.0065 0.0134 -0.927 -0.866 1.793 -0.331 -0.309 0.64 -0.309 -0.289 0.598 1 C 13 0.9456 -0.1006 -0.3094 0.0733 0.9924 -0.0986 0.317 0.0706 0.9458 -0.2911 -0.2894 0.5805 21.064 20.94 -42.004 7.516 7.472 -14.988 7.026 6.985 -14.011 2 O 17 0.0806 0.9916 -0.1011 0.9472 -0.1077 -0.302 0.3104 0.0714 0.9479 -0.132 -0.1298 0.2618 -22.602 -22.222 44.824 -8.065 -7.929 15.994 -7.539 -7.412 14.952 3 B 11 -0.5837 0.8003 0.1373 0.7389 0.5936 -0.319 0.3368 0.0847 0.9378 -0.0639 -0.0607 0.1246 -8.574 -8.15 16.724 -3.059 -2.908 5.967 -2.86 -2.719 5.578 4 C 13 0.6912 0.665 -0.2828 -0.6405 0.745 0.1864 0.3346 0.0523 0.9409 -0.0639 -0.0607 0.1246 -8.575 -8.151 16.726 -3.06 -2.908 5.968 -2.86 -2.719 5.579 5 C 13 0.3094 0.0762 0.9479 0.793 -0.5708 -0.213 0.5248 0.8175 -0.2371 -0.0278 0.0117 0.0161 -3.736 1.57 2.167 -1.333 0.56 0.773 -1.246 0.524 0.723 6 C 13 0.3092 0.0672 0.9486 0.8642 0.3965 -0.3098 -0.3969 0.9156 0.0645 -0.0279 0.0117 0.0162 -3.745 1.574 2.171 -1.336 0.562 0.775 -1.249 0.525 0.724 7 C 13 0.3258 0.0402 0.9446 0.9446 -0.0561 -0.3234 0.04 0.9976 -0.0562 -0.0641 0.0281 0.0359 -8.601 3.777 4.823 -3.069 1.348 1.721 -2.869 1.26 1.609 8 C 13 0.8769 0.3628 -0.3153 -0.3549 0.9311 0.0845 0.3243 0.0378 0.9452 -0.0617 -0.0549 0.1166 -8.276 -7.369 15.644 -2.953 -2.629 5.582 -2.76 -2.458 5.218 9 C 13 0.3206 0.0373 0.9465 0.7621 0.5833 -0.2811 -0.5626 0.8114 0.1586 -0.0668 0.0289 0.0378 -8.957 3.881 5.076 -3.196 1.385 1.811 -2.988 1.295 1.693 10 C 13 0.9518 0.0077 -0.3066 -0.0196 0.9992 -0.036 0.3061 0.0402 0.9512 -0.0913 -0.0841 0.1754 -3.521 -3.244 6.765 -1.256 -1.157 2.414 -1.175 -1.082 2.257 11 N 14 0.8682 0.0238 -0.4957 0.4941 0.053 0.8678 -0.047 0.9983 -0.0342 -0.0032 -0.0031 0.0063 -1.708 -1.68 3.388 -0.609 -0.599 1.209 -0.57 -0.56 1.13 12 H 1 0.8802 0.3532 -0.317 0.3234 0.0425 0.9453 -0.3474 0.9346 0.0768 -0.0083 0.0 0.0083 -4.448 0.001 4.448 -1.587 0.0 1.587 -1.484 0.0 1.484 13 H 1 0.3724 0.0888 0.9238 0.6997 0.627 -0.3423 -0.6097 0.7739 0.1714 -0.0024 -0.002 0.0044 -1.274 -1.089 2.363 -0.455 -0.389 0.843 -0.425 -0.363 0.788 14 H 1 0.3251 0.1024 0.9401 -0.665 0.7316 0.1503 0.6724 0.674 -0.3059 -0.0667 0.0289 0.0378 -8.956 3.881 5.075 -3.196 1.385 1.811 -2.987 1.294 1.693 15 C 13 0.8102 -0.5411 -0.2253 0.4853 0.8349 -0.2597 0.3286 0.101 0.939 -0.0617 -0.0549 0.1165 -8.273 -7.367 15.64 -2.952 -2.629 5.581 -2.76 -2.457 5.217 16 C 13 0.3298 0.0984 0.9389 0.938 -0.1462 -0.3142 0.1063 0.9843 -0.1405 -0.0641 0.0281 0.0359 -8.599 3.777 4.822 -3.068 1.348 1.721 -2.868 1.26 1.609 17 C 13 0.9361 -0.2057 -0.2853 0.1651 0.9732 -0.1599 0.3105 0.1026 0.945 -0.0913 -0.0841 0.1753 -3.52 -3.242 6.762 -1.256 -1.157 2.413 -1.174 -1.082 2.256 18 N 14 0.8532 -0.246 -0.46 0.4849 0.049 0.8732 0.1923 0.968 -0.1611 -0.0032 -0.0031 0.0063 -1.708 -1.68 3.388 -0.609 -0.599 1.209 -0.57 -0.56 1.13 19 H 1 0.3684 0.0407 0.9288 -0.5961 0.777 0.2024 0.7134 0.6282 -0.3105 -0.0024 -0.002 0.0044 -1.274 -1.089 2.363 -0.454 -0.389 0.843 -0.425 -0.363 0.788 20 H 1 0.8148 -0.5327 -0.2287 0.327 0.0966 0.9401 0.4786 0.8408 -0.2529 -0.0083 0.0 0.0083 -4.447 0.001 4.446 -1.587 0.0 1.587 -1.483 0.0 1.483 21 H 1 0.3334 0.0691 0.9402 0.074 0.9923 -0.0992 0.9399 -0.1026 -0.3257 -0.0185 0.0052 0.0133 -2.488 0.697 1.791 -0.888 0.249 0.639 -0.83 0.232 0.598 22 C 13 0.1591 0.9778 -0.1362 0.9501 -0.1892 -0.248 0.2683 0.09 0.9591 -0.012 -0.0081 0.0201 -1.608 -1.085 2.692 -0.574 -0.387 0.961 -0.536 -0.362 0.898 23 C 13 -0.0133 0.9981 -0.0605 0.9639 -0.0033 -0.2664 0.2661 0.0618 0.962 -0.0119 -0.008 0.02 -1.602 -1.079 2.681 -0.572 -0.385 0.957 -0.534 -0.36 0.894 24 C 13 0.6158 0.756 -0.2219 0.2548 0.0754 0.964 0.7455 -0.6502 -0.1462 -0.0022 -0.0014 0.0036 -1.188 -0.751 1.938 -0.424 -0.268 0.692 -0.396 -0.25 0.647 25 H 1 -0.4965 0.8659 0.0607 0.2551 0.0788 0.9637 0.8297 0.494 -0.26 -0.0022 -0.0014 0.0036 -1.185 -0.751 1.936 -0.423 -0.268 0.691 -0.395 -0.251 0.646 26 H 1 -0.2822 0.9592 0.0144 0.9256 0.2762 -0.2586 0.252 0.0597 0.9659 -0.1005 -0.0932 0.1937 -3.878 -3.594 7.472 -1.384 -1.283 2.666 -1.293 -1.199 2.492 27 N 14 0.5872 0.1566 0.7942 0.7584 0.2367 -0.6074 -0.2831 0.9589 0.0202 -0.0044 -0.0036 0.008 -2.335 -1.927 4.262 -0.833 -0.688 1.521 -0.779 -0.643 1.422 28 H 1 0.418 0.8866 -0.198 0.872 -0.4527 -0.1861 0.2546 0.0948 0.9624 -0.1005 -0.0932 0.1937 -3.877 -3.594 7.472 -1.384 -1.282 2.666 -1.293 -1.199 2.492 29 N 14 0.5725 -0.0828 0.8157 0.7054 -0.4573 -0.5415 0.4179 0.8854 -0.2034 -0.0044 -0.0036 0.008 -2.334 -1.931 4.265 -0.833 -0.689 1.522 -0.779 -0.644 1.423 30 H 1 0.0735 0.9923 -0.0993 0.9375 -0.1027 -0.3325 0.3401 0.0687 0.9379 -0.0022 -0.0018 0.0041 -0.087 -0.071 0.158 -0.031 -0.025 0.056 -0.029 -0.024 0.053 31 N 14 0.7472 0.6052 -0.2746 -0.5508 0.7951 0.2539 0.372 -0.0384 0.9274 -0.0032 -0.0027 0.0059 -0.435 -0.359 0.794 -0.155 -0.128 0.283 -0.145 -0.12 0.265 32 C 13 0.1474 0.9779 0.148 0.7555 -0.0148 -0.6549 0.6383 -0.2084 0.741 -0.0013 -8.0E-4 0.0021 -0.7 -0.442 1.143 -0.25 -0.158 0.408 -0.234 -0.148 0.381 33 H 1 -0.4124 0.7695 0.4877 0.864 0.5002 -0.0585 0.289 -0.3972 0.871 -0.0012 -9.0E-4 0.0021 -0.638 -0.462 1.1 -0.228 -0.165 0.392 -0.213 -0.154 0.367 34 H 1 0.7466 0.654 -0.1218 -0.4614 0.641 0.6133 0.4792 -0.4018 0.7804 -0.0039 -0.0033 0.0071 -2.058 -1.751 3.808 -0.734 -0.625 1.359 -0.686 -0.584 1.27 35 H 1 0.0742 0.9923 -0.0995 0.9726 -0.0941 -0.2124 0.2202 0.081 0.9721 -0.0026 -0.0017 0.0043 -0.352 -0.23 0.582 -0.125 -0.082 0.208 -0.117 -0.077 0.194 36 C 13 -0.1192 0.9857 0.1188 0.9924 0.1221 -0.0166 0.0309 -0.1159 0.9928 -0.0012 -9.0E-4 0.0021 -0.639 -0.475 1.114 -0.228 -0.169 0.398 -0.213 -0.158 0.372 37 H 1 0.261 0.9143 -0.3097 0.9633 -0.2674 0.0224 0.0624 0.3042 0.9506 -0.0012 -9.0E-4 0.0021 -0.639 -0.475 1.114 -0.228 -0.17 0.398 -0.213 -0.159 0.372 38 H 1 0.074 0.9922 -0.0999 0.992 -0.063 0.1094 -0.1023 0.1072 0.989 -0.0042 -0.0015 0.0057 -2.251 -0.804 3.055 -0.803 -0.287 1.09 -0.751 -0.268 1.019 39 H 1 -0.6456 0.751 0.1386 0.6579 0.6391 -0.3984 0.3878 0.166 0.9067 -0.0032 -0.0026 0.0059 -0.431 -0.355 0.786 -0.154 -0.127 0.281 -0.144 -0.118 0.262 40 C 13 -0.5119 -0.5905 0.6239 0.7809 -0.6225 0.0515 0.358 0.5135 0.7798 -0.0012 -9.0E-4 0.0021 -0.636 -0.463 1.099 -0.227 -0.165 0.392 -0.212 -0.154 0.366 41 H 1 -0.0048 0.9408 -0.3389 0.7401 -0.2246 -0.6339 0.6725 0.2539 0.6952 -0.0013 -8.0E-4 0.0021 -0.698 -0.444 1.142 -0.249 -0.158 0.407 -0.233 -0.148 0.381 42 H 1 PT41045.200S 2024-12-17T17:33:47.000 -14.41318 -10.36055 -10.35831 -10.35271 -10.35199 -10.32635 -10.32632 -10.30166 -10.30164 -10.30141 -10.30139 -10.29336 -10.29334 -10.29074 -10.29073 -10.28933 -10.28931 -10.28514 -6.79921 -1.16615 -1.12580 -1.04171 -1.04167 -1.02757 -1.01259 -0.90947 -0.90079 -0.89468 -0.87421 -0.84868 -0.79136 -0.78880 -0.76345 -0.76012 -0.74595 -0.73470 -0.72323 -0.70101 -0.68930 -0.67094 -0.64253 -0.61478 -0.61271 -0.59339 -0.57768 -0.57422 -0.56296 -0.56031 -0.55634 -0.54729 -0.54626 -0.54362 -0.54360 -0.54313 -0.51351 -0.50374 -0.49700 -0.49006 -0.48785 -0.47724 -0.47436 -0.46745 -0.46336 -0.45977 -0.44016 -0.43789 -0.43324 -0.43311 -0.42832 -0.41296 -0.38559 -0.36957 -0.36276 -0.34943 -0.34764 -0.34500 -0.32822 -0.32446 -0.27944 -0.21602 -0.00624 0.04075 0.04564 0.04716 0.07243 0.10024 0.11892 0.12166 0.12673 0.13563 0.13962 0.14127 0.14331 0.15619 0.15691 0.16802 0.16875 0.17283 0.17937 0.18047 0.18312 0.18463 0.18586 0.19248 0.19883 0.20928 0.21050 0.21588 0.22592 0.23255 0.23482 0.23846 0.23891 0.24627 0.24892 0.25431 0.25665 0.26423 0.26561 0.26835 0.27984 0.28219 0.28627 0.28745 0.29924 0.30090 0.30575 0.30929 0.31078 0.31478 0.32077 0.32302 0.33017 0.33063 0.33394 0.33642 0.34131 0.34872 0.35443 0.35760 0.36153 0.36435 0.37675 0.38194 0.38739 0.38790 0.39192 0.39605 0.40429 0.41078 0.41806 0.41849 0.42168 0.42563 0.42954 0.43402 0.43500 0.44018 0.44326 0.44332 0.44496 0.45993 0.46048 0.46956 0.47066 0.47495 0.47511 0.48196 0.48246 0.48932 0.49036 0.49219 0.49969 0.50092 0.50651 0.50729 0.51588 0.52188 0.52513 0.52622 0.53210 0.53548 0.53688 0.54608 0.54868 0.55169 0.55342 0.55596 0.55957 0.56355 0.56660 0.57677 0.57965 0.58182 0.58617 0.58976 0.59624 0.60157 0.60724 0.60938 0.61002 0.61532 0.61578 0.62155 0.62712 0.63124 0.63941 0.65529 0.65583 0.66272 0.66535 0.67144 0.67339 0.67833 0.67952 0.68315 0.69415 0.69685 0.70606 0.71529 0.72048 0.72287 0.73277 0.73372 0.74546 0.74626 0.74974 0.75607 0.76205 0.76410 0.76679 0.77061 0.77444 0.78330 0.78945 0.78971 0.79926 0.80436 0.80586 0.80861 0.81186 0.81518 0.82247 0.82449 0.82605 0.82695 0.84158 0.84435 0.84656 0.85461 0.85654 0.85812 0.87001 0.88433 0.89350 0.89391 0.89710 0.90792 0.92279 0.92670 0.92875 0.93085 0.93825 0.94251 0.94420 0.95226 0.95236 0.95800 0.96127 0.96805 0.97453 0.98646 0.99101 1.00506 1.00588 1.01410 1.02026 1.02525 1.02942 1.03450 1.04088 1.04204 1.04541 1.05240 1.05385 1.06404 1.06952 1.08074 1.09452 1.09507 1.10161 1.10740 1.11205 1.11333 1.11528 1.12353 1.12817 1.13212 1.13356 1.14149 1.14723 1.14824 1.15718 1.16606 1.16861 1.17338 1.18176 1.18244 1.18579 1.19875 1.20830 1.21924 1.21982 1.22427 1.23146 1.23363 1.23779 1.24398 1.25062 1.25077 1.25586 1.26111 1.27960 1.28084 1.28904 1.29247 1.30928 1.31210 1.32514 1.32627 1.33210 1.33563 1.34298 1.34378 1.35459 1.36045 1.36204 1.37045 1.37235 1.38110 1.38610 1.39054 1.39215 1.39241 1.39921 1.40369 1.40781 1.41739 1.42113 1.42222 1.42726 1.43097 1.44192 1.44540 1.45477 1.45519 1.46195 1.46607 1.47593 1.48154 1.48420 1.50130 1.50139 1.51075 1.51296 1.52265 1.52520 1.52683 1.53321 1.54055 1.55063 1.55464 1.55660 1.57251 1.57712 1.57737 1.58163 1.58757 1.58889 1.59304 1.60065 1.60364 1.60999 1.61434 1.62434 1.62821 1.63407 1.63597 1.63918 1.64498 1.65442 1.66203 1.66252 1.67660 1.68182 1.68807 1.70443 1.70449 1.71635 1.71963 1.72751 1.73310 1.74210 1.74805 1.75095 1.75726 1.75776 1.76835 1.78022 1.78329 1.78437 1.79187 1.79346 1.80004 1.80169 1.81513 1.82892 1.84049 1.84375 1.84736 1.85275 1.85544 1.87312 1.87407 1.88488 1.89205 1.90346 1.91326 1.91411 1.91647 1.92170 1.92729 1.94937 1.95141 1.95236 1.97325 1.97807 1.98118 1.98980 1.99183 1.99550 2.00270 2.01269 2.03837 2.05407 2.05785 2.07024 2.07809 2.08671 2.08723 2.09674 2.10461 2.11154 2.12197 2.13378 2.14000 2.16898 2.17941 2.18096 2.18550 2.20144 2.20574 2.22224 2.22864 2.23835 2.25254 2.26161 2.26181 2.26820 2.29402 2.29436 2.30379 2.30580 2.31285 2.33167 2.33573 2.33857 2.36331 2.37032 2.38474 2.38665 2.40293 2.41209 2.41417 2.41780 2.42464 2.42822 2.43291 2.44086 2.44371 2.46820 2.48139 2.48712 2.50047 2.50801 2.52445 2.53548 2.54405 2.55932 2.57382 2.57620 2.58106 2.58471 2.62246 2.62819 2.63531 2.64360 2.65048 2.65566 2.66660 2.67408 2.68094 2.68780 2.70645 2.71315 2.72052 2.74335 2.74355 2.74919 2.75149 2.76965 2.77044 2.77837 2.78372 2.78679 2.79037 2.79088 2.79429 2.79869 2.80656 2.81207 2.82271 2.83262 2.84827 2.85067 2.86012 2.86587 2.86614 2.86937 2.87644 2.87917 2.90150 2.92062 2.92173 2.92251 2.93192 2.93906 2.94778 2.95187 2.95314 2.95460 2.96190 2.96647 2.97682 2.97812 2.98693 2.98906 2.99120 2.99346 2.99712 3.00708 3.01438 3.01951 3.02264 3.02967 3.03013 3.03991 3.04647 3.05396 3.05875 3.06091 3.06228 3.06484 3.07229 3.07884 3.08550 3.08872 3.09755 3.10007 3.10598 3.10892 3.11105 3.11276 3.13241 3.13511 3.14021 3.15157 3.15518 3.16480 3.16681 3.17414 3.17489 3.18114 3.18889 3.19822 3.19947 3.20228 3.20332 3.20478 3.21048 3.21391 3.22212 3.22430 3.22716 3.22836 3.24587 3.24984 3.25119 3.25989 3.27093 3.27559 3.28672 3.28841 3.29368 3.29793 3.30239 3.30325 3.31114 3.31688 3.32980 3.33223 3.33280 3.33380 3.34198 3.34690 3.35545 3.35889 3.35982 3.37272 3.37932 3.39302 3.40675 3.40854 3.41620 3.41895 3.42272 3.43077 3.43526 3.43904 3.44926 3.44960 3.45538 3.46356 3.47272 3.47983 3.48312 3.48471 3.49115 3.50152 3.50295 3.51127 3.51264 3.51910 3.52128 3.52410 3.52458 3.52859 3.53870 3.54250 3.55282 3.56365 3.56523 3.57899 3.57956 3.58478 3.58999 3.59005 3.59781 3.60351 3.60630 3.61281 3.61489 3.61720 3.62077 3.62264 3.63224 3.63716 3.65055 3.65103 3.66068 3.66585 3.66874 3.67243 3.68232 3.68387 3.68989 3.69651 3.70672 3.71221 3.71373 3.71581 3.71852 3.73229 3.74031 3.75219 3.75647 3.76250 3.77903 3.79053 3.79378 3.79759 3.80644 3.81602 3.81908 3.82916 3.83079 3.83909 3.84278 3.84752 3.85739 3.86115 3.86390 3.87350 3.88113 3.88212 3.89742 3.89760 3.90329 3.90704 3.91487 3.91602 3.92544 3.92733 3.93253 3.94065 3.94242 3.94761 3.95544 3.96230 3.96507 3.96969 3.98225 3.99028 3.99228 4.00178 4.00430 4.00766 4.01683 4.02081 4.02473 4.03338 4.03349 4.04699 4.04826 4.05278 4.06141 4.07135 4.09744 4.11789 4.12345 4.13679 4.14503 4.14880 4.15754 4.15793 4.16300 4.16972 4.17104 4.17756 4.18614 4.18707 4.20132 4.20607 4.21129 4.22184 4.23485 4.24038 4.24566 4.25423 4.25625 4.26563 4.27381 4.27546 4.28346 4.28708 4.28962 4.29302 4.29758 4.30288 4.31635 4.31652 4.31915 4.31967 4.33996 4.34002 4.35188 4.36312 4.37323 4.37583 4.38180 4.39042 4.39879 4.40433 4.40470 4.41180 4.41421 4.42966 4.44126 4.44930 4.45013 4.45420 4.45572 4.45787 4.47185 4.47953 4.48585 4.49533 4.49975 4.50729 4.52201 4.53250 4.54948 4.55353 4.56058 4.57263 4.58241 4.59399 4.60329 4.61847 4.62158 4.63341 4.64399 4.65557 4.66224 4.67401 4.67800 4.70393 4.70593 4.72601 4.74511 4.75075 4.76255 4.76966 4.77359 4.77399 4.78887 4.79062 4.80308 4.81404 4.81418 4.83362 4.85552 4.86217 4.86500 4.86995 4.89847 4.90852 4.91041 4.91852 4.92569 4.94136 4.95893 4.96324 4.97392 4.99703 4.99977 5.00355 5.01394 5.02099 5.02338 5.05973 5.06356 5.07673 5.08083 5.08661 5.08788 5.09005 5.09743 5.10062 5.11160 5.11575 5.11723 5.13135 5.16285 5.16787 5.17430 5.17605 5.17972 5.18599 5.19290 5.22476 5.23014 5.23604 5.23725 5.24070 5.25597 5.25927 5.26142 5.26741 5.27242 5.28186 5.31320 5.32482 5.34067 5.34257 5.35240 5.35457 5.35516 5.36247 5.37485 5.38395 5.39269 5.39548 5.40146 5.40552 5.40891 5.41870 5.42718 5.42921 5.43052 5.43443 5.44039 5.45563 5.46569 5.47025 5.49176 5.50838 5.50975 5.54179 5.54611 5.56120 5.57098 5.57111 5.59375 5.59839 5.60006 5.64185 5.67080 5.68272 5.68689 5.69889 5.71354 5.72648 5.74209 5.74819 5.75446 5.76390 5.78067 5.78435 5.80463 5.80509 5.81732 5.81849 5.82745 5.85137 5.85970 5.86265 5.86749 5.91250 5.92048 5.93614 5.93639 5.96463 5.99291 6.02227 6.02682 6.05608 6.06962 6.09681 6.10902 6.11889 6.15357 6.18807 6.20401 6.23358 6.26860 6.28684 6.35564 6.50099 6.52430 6.53495 6.57291 6.70550 6.80254 6.81496 6.93759 6.95801 7.02673 7.15018 7.24467 7.35113 16.05774 22.99483 23.01996 23.05324 23.15450 23.23905 23.26788 23.30108 23.34777 23.41704 23.52902 23.65071 23.70461 23.74634 23.74911 23.75254 23.79927 23.96104 32.87426 32.91055 32.92949 33.06096 33.08202 44.20112 -19.21234 -14.50780 -14.50776 -14.43411 -14.43407 -14.41316 -10.36117 -10.35863 -10.35255 -10.35184 -10.32710 -10.32707 -10.30240 -10.30237 -10.30215 -10.30213 -10.29212 -10.29210 -10.28942 -10.28941 -10.28929 -10.28927 -10.28513 -6.79620 -1.16411 -1.11942 -1.03975 -1.03967 -1.02432 -1.01256 -0.90655 -0.89913 -0.89271 -0.87219 -0.84758 -0.79125 -0.78873 -0.76031 -0.75890 -0.74503 -0.73045 -0.72152 -0.70092 -0.68695 -0.67079 -0.64063 -0.61394 -0.60882 -0.59223 -0.57662 -0.56871 -0.56253 -0.55932 -0.55230 -0.54597 -0.54540 -0.54349 -0.54349 -0.54190 -0.50644 -0.50104 -0.49498 -0.48729 -0.48678 -0.47611 -0.47307 -0.46311 -0.46275 -0.45267 -0.43769 -0.43765 -0.43300 -0.43294 -0.41822 -0.41096 -0.37069 -0.36368 -0.35073 -0.34642 -0.34242 -0.33599 -0.32363 -0.32077 -0.27906 -0.03203 0.00304 0.04810 0.05473 0.06150 0.07631 0.10022 0.11887 0.12170 0.13370 0.13552 0.13942 0.14120 0.14352 0.15628 0.15805 0.16813 0.17175 0.17782 0.18046 0.18322 0.18375 0.18517 0.18672 0.19268 0.19914 0.20970 0.21062 0.22230 0.22807 0.23252 0.23495 0.23877 0.24074 0.24629 0.25072 0.25442 0.25703 0.26415 0.26541 0.26931 0.27996 0.28244 0.28675 0.28733 0.30155 0.30184 0.30742 0.31046 0.31095 0.31677 0.32094 0.32964 0.33040 0.33358 0.33458 0.33640 0.34077 0.34937 0.35449 0.35816 0.36196 0.36778 0.37756 0.38318 0.38812 0.38816 0.39198 0.39688 0.40525 0.41081 0.41866 0.42162 0.42237 0.42678 0.42972 0.43503 0.43570 0.44085 0.44363 0.44392 0.45013 0.46047 0.46110 0.46989 0.47092 0.47539 0.47575 0.48227 0.48389 0.49032 0.49152 0.49259 0.50142 0.50503 0.50681 0.50850 0.51615 0.52233 0.52608 0.52660 0.53297 0.53622 0.53830 0.54661 0.55025 0.55202 0.55389 0.55741 0.56006 0.56392 0.56751 0.57785 0.58010 0.58385 0.58772 0.59099 0.59733 0.60200 0.60766 0.60978 0.61030 0.61620 0.61649 0.62257 0.62739 0.63217 0.64085 0.65663 0.65716 0.66310 0.66609 0.67198 0.67368 0.67933 0.68040 0.68397 0.69453 0.69818 0.70715 0.71635 0.72086 0.72303 0.73428 0.73448 0.74618 0.74688 0.75022 0.75711 0.76305 0.76479 0.76717 0.77188 0.77546 0.78539 0.78963 0.79007 0.79990 0.80485 0.80786 0.80864 0.81308 0.81570 0.82294 0.82564 0.82743 0.82756 0.84204 0.84521 0.84697 0.85563 0.85736 0.85981 0.87059 0.88452 0.89366 0.89385 0.89860 0.90828 0.92439 0.92726 0.92926 0.93166 0.93985 0.94378 0.94431 0.95248 0.95270 0.95827 0.96210 0.96817 0.97566 0.98682 0.99146 1.00568 1.00615 1.01475 1.02093 1.02570 1.03039 1.03480 1.04100 1.04264 1.04566 1.05375 1.05451 1.06517 1.07032 1.08104 1.09533 1.09538 1.10227 1.10807 1.11297 1.11444 1.11545 1.12439 1.12938 1.13387 1.13455 1.14162 1.14783 1.14857 1.15815 1.16640 1.16885 1.17502 1.18297 1.18347 1.18669 1.19937 1.20863 1.21966 1.21983 1.22479 1.23173 1.23411 1.23880 1.24470 1.25090 1.25123 1.25742 1.26307 1.27963 1.28162 1.28933 1.29381 1.30931 1.31232 1.32761 1.32792 1.33353 1.33594 1.34380 1.34590 1.35549 1.36113 1.36315 1.37169 1.37327 1.38180 1.38697 1.39079 1.39315 1.39353 1.40023 1.40471 1.40795 1.41922 1.42126 1.42316 1.42891 1.43155 1.44245 1.44647 1.45551 1.45573 1.46382 1.46659 1.47694 1.48327 1.48448 1.50182 1.50224 1.51199 1.51446 1.52334 1.52620 1.52700 1.53366 1.54040 1.55212 1.55536 1.55749 1.57378 1.57770 1.57914 1.58195 1.58928 1.59002 1.59369 1.60174 1.60466 1.61118 1.61640 1.62625 1.62829 1.63470 1.63714 1.64228 1.64669 1.65567 1.66248 1.66305 1.67828 1.68290 1.68853 1.70479 1.70571 1.71697 1.72096 1.73008 1.73542 1.74349 1.74870 1.75162 1.75851 1.75858 1.76990 1.78129 1.78398 1.78628 1.79249 1.79549 1.80095 1.80318 1.81793 1.82981 1.84261 1.84518 1.85023 1.85424 1.85674 1.87471 1.87633 1.88576 1.89439 1.90515 1.91469 1.91519 1.91839 1.92262 1.92935 1.95062 1.95188 1.95467 1.97471 1.98178 1.98260 1.99132 1.99372 1.99676 2.00562 2.01359 2.04015 2.05491 2.05873 2.07328 2.07969 2.08733 2.08930 2.09871 2.10913 2.11262 2.12389 2.13633 2.14178 2.17011 2.17986 2.18236 2.18939 2.20292 2.20663 2.22638 2.23174 2.24095 2.26280 2.26362 2.26641 2.27738 2.29489 2.29595 2.30486 2.30757 2.31406 2.33423 2.34099 2.34504 2.36644 2.37638 2.38666 2.38930 2.40417 2.41498 2.41538 2.41927 2.42624 2.43252 2.43831 2.44262 2.44614 2.46942 2.48243 2.48863 2.50537 2.51198 2.52862 2.53897 2.54585 2.56091 2.57614 2.57936 2.58427 2.58999 2.62536 2.63049 2.63764 2.64657 2.65131 2.65640 2.66853 2.67577 2.68218 2.68954 2.71156 2.71827 2.72471 2.74366 2.74715 2.75004 2.75242 2.77042 2.77182 2.78014 2.78484 2.78781 2.79177 2.79229 2.79504 2.79968 2.80805 2.81402 2.82446 2.83438 2.84988 2.85186 2.86231 2.86762 2.86771 2.87135 2.87781 2.88114 2.90381 2.92132 2.92217 2.92325 2.93217 2.93983 2.94833 2.95308 2.95356 2.95488 2.96356 2.96704 2.97828 2.97886 2.98730 2.98982 2.99229 2.99464 2.99898 3.00844 3.01484 3.01984 3.02321 3.03022 3.03038 3.04145 3.04727 3.05475 3.05933 3.06142 3.06366 3.06527 3.07357 3.08007 3.08693 3.09047 3.09915 3.10055 3.10662 3.11020 3.11210 3.11283 3.13301 3.13577 3.14071 3.15235 3.15623 3.16617 3.16770 3.17509 3.17571 3.18183 3.18985 3.19866 3.20001 3.20247 3.20454 3.20663 3.21147 3.21465 3.22262 3.22541 3.22772 3.22911 3.24605 3.25056 3.25246 3.25991 3.27196 3.27564 3.28789 3.28886 3.29442 3.29825 3.30310 3.30362 3.31185 3.31761 3.33018 3.33269 3.33311 3.33465 3.34323 3.34892 3.35649 3.35994 3.36059 3.37420 3.38014 3.39381 3.40763 3.41010 3.41717 3.42048 3.42399 3.43098 3.43550 3.44006 3.45033 3.45059 3.45609 3.46445 3.47332 3.48041 3.48347 3.48497 3.49139 3.50180 3.50310 3.51258 3.51307 3.51969 3.52250 3.52505 3.52508 3.52897 3.53955 3.54370 3.55376 3.56591 3.56611 3.58065 3.58107 3.58509 3.59050 3.59110 3.59826 3.60449 3.60727 3.61405 3.61589 3.61837 3.62139 3.62320 3.63244 3.63778 3.65061 3.65161 3.66231 3.66646 3.66937 3.67453 3.68249 3.68517 3.69087 3.69714 3.70696 3.71285 3.71527 3.71704 3.71869 3.73311 3.74119 3.75389 3.75669 3.76334 3.77997 3.79115 3.79396 3.79851 3.80776 3.81635 3.81971 3.82976 3.83125 3.84011 3.84319 3.84803 3.85778 3.86189 3.86483 3.87449 3.88269 3.88492 3.89815 3.89837 3.90392 3.90719 3.91611 3.91694 3.92611 3.92777 3.93350 3.94126 3.94265 3.94790 3.95563 3.96257 3.96588 3.97067 3.98354 3.99122 3.99324 4.00233 4.00475 4.00789 4.01788 4.02101 4.02615 4.03424 4.03432 4.04729 4.04892 4.05359 4.06249 4.07193 4.09852 4.11907 4.12384 4.13838 4.14541 4.14926 4.15844 4.15913 4.16335 4.16996 4.17156 4.17901 4.18631 4.18781 4.20267 4.20710 4.21251 4.22317 4.23559 4.24119 4.24712 4.25516 4.25654 4.26672 4.27425 4.27577 4.28469 4.28768 4.29005 4.29412 4.29783 4.30365 4.31656 4.31698 4.31977 4.31996 4.34033 4.34170 4.35192 4.36365 4.37392 4.37675 4.38255 4.39106 4.39993 4.40508 4.40562 4.41283 4.41552 4.43051 4.44177 4.44949 4.45157 4.45504 4.45638 4.45793 4.47277 4.48021 4.48774 4.49556 4.50001 4.50788 4.52300 4.53337 4.55157 4.55456 4.56147 4.57418 4.58388 4.59484 4.60429 4.61947 4.62459 4.63471 4.64463 4.65656 4.66302 4.67463 4.67914 4.70398 4.70596 4.72695 4.74610 4.75250 4.76285 4.76975 4.77395 4.77430 4.78963 4.79190 4.80570 4.81409 4.81580 4.83763 4.85905 4.86331 4.86582 4.87178 4.89919 4.90945 4.91139 4.91927 4.92605 4.94173 4.95904 4.96426 4.97603 5.00017 5.00064 5.00375 5.01464 5.02498 5.02701 5.06067 5.06507 5.07691 5.08180 5.08904 5.08951 5.09325 5.09757 5.10150 5.11184 5.11625 5.11760 5.13225 5.16329 5.16830 5.17691 5.17706 5.18182 5.18856 5.19386 5.22574 5.23121 5.23639 5.23961 5.24162 5.25711 5.26114 5.26222 5.26747 5.27257 5.28254 5.32162 5.32869 5.34279 5.34343 5.35292 5.35537 5.35559 5.36313 5.37598 5.38602 5.39366 5.39623 5.40237 5.40567 5.41038 5.42022 5.42761 5.43086 5.43129 5.43566 5.44167 5.45772 5.46741 5.47277 5.49269 5.50902 5.50996 5.54312 5.54702 5.56192 5.57213 5.57328 5.59419 5.59899 5.60128 5.64239 5.67106 5.68283 5.68742 5.70011 5.71914 5.72663 5.74236 5.75105 5.75564 5.76405 5.78076 5.78501 5.80587 5.80684 5.81840 5.81859 5.82781 5.85159 5.86007 5.86267 5.86759 5.91431 5.92138 5.93745 5.93750 5.96467 5.99367 6.02328 6.02775 6.05802 6.07033 6.09724 6.10910 6.11899 6.15431 6.18875 6.20480 6.24198 6.26900 6.28760 6.35657 6.51265 6.52571 6.53837 6.57376 6.70637 6.81293 6.81598 6.94757 6.95936 7.02840 7.15147 7.24970 7.35309 16.06429 22.99501 23.02099 23.05381 23.15410 23.23950 23.26890 23.30097 23.34769 23.41619 23.52852 23.65094 23.70432 23.74619 23.74913 23.75257 23.79931 23.96076 32.87590 32.91218 32.92951 33.06260 33.08365 44.20428 5.7799 -0.6674 -2.4441 6.3108 -133.6731 -118.8613 -147.0018 0.0057 -11.6520 -1.9815 -0.4944 14.3175 -13.8231 0.0057 -11.6520 -1.9815 120.3170 -1.0186 -15.0137 -13.3136 -17.1243 -46.9059 -1.7850 -2.4661 -2.4896 4.5118 -3722.8928 -3053.9479 -2117.2138 39.3610 -14.2967 5.3343 31.7252 67.8231 58.7549 -1062.2656 -947.5353 -918.0931 10.1387 -9.8729 10.7104 GINC-BERON207 GRUFOR 2024-12-17T00:00:00.000 0 coments 0 2 Version=ES64L-G16RevC.02 HF=-1033.1430915 S2=0.778725 S2-1=0. S2A=0.750695 RMSD=1.345e-09 Dipole=2.2739831,-0.2625623,-0.9615958 Quadrupole=-0.3675753,10.6446766,-10.2771013,0.0042269,-8.6629657,-1.4731914 PG=C01 [X(C17H19B1N5O1)] 0 -2.5872050921 0.2047284247 0.0399997724 0 -3.7432177806 0.3279733679 0.4215671162 0 0.1965635303 -0.0945737082 -0.9025650931 0 -1.9609373993 -1.1443818766 -0.0629741113 0 -1.7729473712 1.4018420096 -0.3161432281 0 -0.4366174244 1.2940771036 -0.7738715476 0 -0.6298261268 -1.3239687268 -0.5133559658 0 -2.3439445719 2.6722142942 -0.1777344704 0 -1.584722136 3.7895869879 -0.4870903519 0 -0.2662383819 3.5971966603 -0.92743834 0 0.2955240481 2.408454625 -1.0703137775 0 -3.3747790963 2.7472166415 0.1756791279 0 -1.9885507946 4.7987107504 -0.391520185 0 0.3564915061 4.465344428 -1.1727082402 0 -0.7987042751 -3.612330013 -0.2106746592 0 -2.1248010902 -3.5208521173 0.2393155059 0 -2.7088009715 -2.2662053884 0.3129120186 0 -0.0719474676 -2.5692335765 -0.5751238234 0 -3.7344648391 -2.1196565955 0.6589153969 0 -0.3125736264 -4.5929168076 -0.2720907553 0 -2.6698783905 -4.422044465 0.5243985834 0 1.663681115 -0.2453534766 -1.3316211274 0 3.6628745731 -1.1252904514 -1.7846019996 0 3.7623511925 0.2301654496 -1.919384906 0 4.4089478521 -1.9019904989 -1.9180541508 0 4.6109837571 0.84945359 -2.191448504 0 2.5200738525 0.7463117945 -1.638677194 0 2.1579813308 1.7105006847 -1.6000158589 0 2.3630907852 -1.391241957 -1.4261129898 0 1.8662156475 -2.2665148218 -1.2046585375 0 1.5307121891 0.190955579 2.9455559535 0 1.9476164138 -1.1006513168 2.4544184127 0 3.0466469252 -1.1749859513 2.4726360208 0 1.5475996111 -1.897386783 3.1008828342 0 1.6067841928 -1.312073619 1.4169888201 0 0.093677851 0.3086363751 3.0393188917 0 -0.3111450275 -0.4935028068 3.6754538154 0 -0.1780776614 1.2715606037 3.4985630239 0 -0.4172835604 0.2484088455 2.0540434481 0 2.1273643257 1.2842916432 2.2162934133 0 1.859965894 2.2429511324 2.6876744864 0 3.2253934034 1.1965969665 2.2354983073 0 1.8060450883 1.3360720001 1.1527108683