Orca 5.0.2 RELEASE 1 2 3 4 11s6p2d1f 11s6p2d1f 11s6p2d1f 5s2p1d 5s3p2d1f 5s3p2d1f 5s3p2d1f 3s2p1d 0 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 O O O N N N N N N N C C C C C C C C C C C C C C C C C C C C H H H H H H H H H H H H H H H H H H H H H H H 1 1 1 2 2 2 2 2 2 2 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 4 4 4 4 4 4 4 4 4 4 4 4 4 386.2590999999997 AuxInfo=1/0/N:12,13,14,30,29,27,28,24,25,26,23,21,20,19,17,16,18,22,15,11,5,4,8,7,10,9,6,3,2,1/E:(1,2,3)(6,7)(9,10)/CRV:5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,14.3,15.3,16.3,17.3,18.3,19.3,21.2,23.2,24.2,25.2,26.2,28.1/rA:53nOOO1NN2NN2N2N2N2CCCCC3C3C3C3C3CC3C3C3C3C3C3C3C3C3CHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;s2;;s6;s8s9;s1;s11;s11;s11;s1s3s4;s4s5;s5;s7;s18;s2s17;s16;s6s8s18;s17;s21s23;s19;s19;s25;s26;s27s28;s6;s12;s12;s12;s13;s13;s13;s14;s14;s14;s4;s20;s20;s21;s23;s24;s25;s26;s27;s28;s29;s30;s30;s30;/rC:-4.0084,.7549,-1.1704;2.2051,-1.616,-.9286;-3.0564,2.6214,-2.0267;-1.8999,.672,-1.738;.2215,-.0218,-2.0628;3.4773,.9604,2.1072;2.6023,-.7309,.0081;2.2971,-.1716,3.4939;3.5885,1.5277,3.2971;2.8845,.8434,4.1113;-5.3442,1.3002,-.9435;-5.9762,1.7585,-2.2496;-6.1072,.1031,-.3949;-5.2992,2.4078,.0985;-3.0086,1.4627,-1.6732;-.6246,.9903,-2.1857;1.4898,.1375,-2.4213;2.2314,-1.023,1.1925;1.3789,-2.1685,1.5815;2.3861,-1.0516,-2.2196;-.2416,2.2262,-2.7123;2.6681,-.1023,2.2345;1.9748,1.3242,-2.9405;1.0789,2.3741,-3.0916;.0869,-2.2784,1.072;1.8566,-3.1319,2.4643;-.7205,-3.339,1.4524;1.0491,-4.1978,2.8332;-.2412,-4.3006,2.332;4.1686,1.5194,.9622;-5.9253,.9747,-3.0068;-5.5219,2.6614,-2.6514;-7.0303,1.9744,-2.0725;-6.1377,-.7151,-1.1158;-5.6614,-.2666,.5296;-7.1344,.3934,-.1768;-6.3199,2.6804,.3689;-4.8055,3.3097,-.2576;-4.7972,2.0713,1.0069;-1.9856,-.2729,-1.3872;2.1279,-1.8521,-2.9143;3.4325,-.7825,-2.3823;-.9327,3.0447,-2.8189;3.0171,1.4274,-3.209;1.4118,3.321,-3.4951;-.2978,-1.5311,.3897;2.8603,-3.0539,2.8618;-1.7259,-3.4137,1.0598;1.4275,-4.9447,3.5182;-.8735,-5.1273,2.6277;4.8197,.7756,.5136;3.4561,1.8714,.2222;4.7645,2.3537,1.3171; Method DFT(GTOs) Exchange WB97X-D3 Correlation WB97X-D3 PostSCFGGA off Hybrid DFT is turned on ScalHFX 0.195728 ScalDFX 0.000000 ScalDFC 1.000000 ScalLDAC 1.000000 Perturbative correction 0.000000 Density functional embedding theory OFF Long-range corrected/Screened/Range-Separated Hybrid DFT is turned on Amount of maximum screened exact exchange 0.804272 Range separation parameter mu (erf(mu*r12)/r12) 0.250000 RI-approximation to the Coulomb term is turned on functions 1723 RIJ-COSX (HFX calculated with COS-X)) on IntName inp HFTyp RHF Charge 0 Mult 1 NEL 216 Dim 1252 ENuc 2866.6765231182 Eh CNVDIIS on DIISMaxIt 12 DIISStart 0.200000 DIISMaxEq 5 DIISBfac 1.050 DIISMaxC 10.000 CNVTRAH auto Auto Start mean grad. ratio tolernc. 1.125000 Auto Start start iteration 20 Auto Start num. interpolation iter. 10 iterations 16 iterations Maxiter - #DIIS iter Number of Davidson start vectors 2 Converg. threshold I (grad. norm) 1.000e-04 Converg. threshold II (energy diff.) 1.000e-07 Micro threshold 0.100 Minimum threshold for Micro iter. 0.010 NR start threshold (gradient norm) 0.001 Initial trust radius 0.400 Minimum AH scaling param. (alpha) 1.000 Maximum AH scaling param. (alpha) 1000.000 Orbital update algorithm Taylor David. guess on Maximum white noise 0.010 Quad. conv. algorithm NR CNVSOSCF off CNVShift on LevelShift 0.2500 ShiftErr 0.0010 CNVZerner off CNVDamp on DampFac 0.7000 DampMax 0.9800 DampMin 0.0000 DampErr 0.1000 CNVRico off MaxIter 125 SCFMode Direct Integral package SHARK and LIBINT hybrid scheme DirectResetFreq 20 Thresh 3.000e-11 Eh TCut 1.000e-12 Eh ConvCheckMode Total+1el-Energy ConvForced 0 TolE 1.000e-07 Eh 1-El. energy change 1.000e-04 Eh TolErr 1.000e-07 Smallest eigenvalue 6.847e-06 Time for diagonalization 0.552 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.277 sec Total time needed 0.837 sec 8 8 8 7 7 7 7 7 7 7 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 386.2590999999997 AuxInfo=1/0/N:12,13,14,30,29,27,28,24,25,26,23,21,20,19,17,16,18,22,15,11,5,4,8,7,10,9,6,3,2,1/E:(1,2,3)(6,7)(9,10)/CRV:5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,14.3,15.3,16.3,17.3,18.3,19.3,21.2,23.2,24.2,25.2,26.2,28.1/rA:53nOOO1NN2NN2N2N2N2CCCCC3C3C3C3C3CC3C3C3C3C3C3C3C3C3CHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;s2;;s6;s8s9;s1;s11;s11;s11;s1s3s4;s4s5;s5;s7;s18;s2s17;s16;s6s8s18;s17;s21s23;s19;s19;s25;s26;s27s28;s6;s12;s12;s12;s13;s13;s13;s14;s14;s14;s4;s20;s20;s21;s23;s24;s25;s26;s27;s28;s29;s30;s30;s30;/rC:-4.0084,.7549,-1.1704;2.2051,-1.616,-.9286;-3.0564,2.6214,-2.0267;-1.8999,.672,-1.738;.2215,-.0218,-2.0628;3.4773,.9604,2.1072;2.6023,-.7309,.0081;2.2971,-.1716,3.4939;3.5885,1.5277,3.2971;2.8845,.8434,4.1113;-5.3442,1.3002,-.9435;-5.9762,1.7585,-2.2496;-6.1072,.1031,-.3949;-5.2992,2.4078,.0985;-3.0086,1.4627,-1.6732;-.6246,.9903,-2.1857;1.4898,.1375,-2.4213;2.2314,-1.023,1.1925;1.3789,-2.1685,1.5815;2.3861,-1.0516,-2.2196;-.2416,2.2262,-2.7123;2.6681,-.1023,2.2345;1.9748,1.3242,-2.9405;1.0789,2.3741,-3.0916;.0869,-2.2784,1.072;1.8566,-3.1319,2.4643;-.7205,-3.339,1.4524;1.0491,-4.1978,2.8332;-.2412,-4.3006,2.332;4.1686,1.5194,.9622;-5.9253,.9747,-3.0068;-5.5219,2.6614,-2.6514;-7.0303,1.9744,-2.0725;-6.1377,-.7151,-1.1158;-5.6614,-.2666,.5296;-7.1344,.3934,-.1768;-6.3199,2.6804,.3689;-4.8055,3.3097,-.2576;-4.7972,2.0713,1.0069;-1.9856,-.2729,-1.3872;2.1279,-1.8521,-2.9143;3.4325,-.7825,-2.3823;-.9327,3.0447,-2.8189;3.0171,1.4274,-3.209;1.4118,3.321,-3.4951;-.2978,-1.5311,.3897;2.8603,-3.0539,2.8618;-1.7259,-3.4137,1.0598;1.4275,-4.9447,3.5182;-.8735,-5.1273,2.6277;4.8197,.7756,.5136;3.4561,1.8714,.2222;4.7645,2.3537,1.3171; 0 1 wb97x-d3 def2-TZVPP def2/J RIJCOSX DEFGRID2 scfconv7 smallprint printgap noloewdin NOSOSCF MaxCore 8000 %output print[P_BondOrder_M] 1 print[P_Mayer] 1 print[P_basis] 2 pal nprocs 4 cpcm smd true smdsolvent "WATER" 386.2590999999997 AuxInfo=1/0/N:12,13,14,30,29,27,28,24,25,26,23,21,20,19,17,16,18,22,15,11,5,4,8,7,10,9,6,3,2,1/E:(1,2,3)(6,7)(9,10)/CRV:5.3,6.3,7.3,8.3,9.3,10.3,11.3,12.3,14.3,15.3,16.3,17.3,18.3,19.3,21.2,23.2,24.2,25.2,26.2,28.1/rA:53nOOO1NN2NN2N2N2N2CCCCC3C3C3C3C3CC3C3C3C3C3C3C3C3C3CHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;s2;;s6;s8s9;s1;s11;s11;s11;s1s3s4;s4s5;s5;s7;s18;s2s17;s16;s6s8s18;s17;s21s23;s19;s19;s25;s26;s27s28;s6;s12;s12;s12;s13;s13;s13;s14;s14;s14;s4;s20;s20;s21;s23;s24;s25;s26;s27;s28;s29;s30;s30;s30;/rC:-4.0084,.7549,-1.1704;2.2051,-1.616,-.9286;-3.0564,2.6214,-2.0267;-1.8999,.672,-1.738;.2215,-.0218,-2.0628;3.4773,.9604,2.1072;2.6023,-.7309,.0081;2.2971,-.1716,3.4939;3.5885,1.5277,3.2971;2.8845,.8434,4.1113;-5.3442,1.3002,-.9435;-5.9762,1.7585,-2.2496;-6.1072,.1031,-.3949;-5.2992,2.4078,.0985;-3.0086,1.4627,-1.6732;-.6246,.9903,-2.1857;1.4898,.1375,-2.4213;2.2314,-1.023,1.1925;1.3789,-2.1685,1.5815;2.3861,-1.0516,-2.2196;-.2416,2.2262,-2.7123;2.6681,-.1023,2.2345;1.9748,1.3242,-2.9405;1.0789,2.3741,-3.0916;.0869,-2.2784,1.072;1.8566,-3.1319,2.4643;-.7205,-3.339,1.4524;1.0491,-4.1978,2.8332;-.2412,-4.3006,2.332;4.1686,1.5194,.9622;-5.9253,.9747,-3.0068;-5.5219,2.6614,-2.6514;-7.0303,1.9744,-2.0725;-6.1377,-.7151,-1.1158;-5.6614,-.2666,.5296;-7.1344,.3934,-.1768;-6.3199,2.6804,.3689;-4.8055,3.3097,-.2576;-4.7972,2.0713,1.0069;-1.9856,-.2729,-1.3872;2.1279,-1.8521,-2.9143;3.4325,-.7825,-2.3823;-.9327,3.0447,-2.8189;3.0171,1.4274,-3.209;1.4118,3.321,-3.4951;-.2978,-1.5311,.3897;2.8603,-3.0539,2.8618;-1.7259,-3.4137,1.0598;1.4275,-4.9447,3.5182;-.8735,-5.1273,2.6277;4.8197,.7756,.5136;3.4561,1.8714,.2222;4.7645,2.3537,1.3171; Epsilon 78.3550 Refrac 1.3328 Rsolv 1.3000 Surface type GAUSSIAN VDW Epsilon function type CPCM O N C H 1.5200 1.8900 1.8500 1.2000 Solvent: WATER Soln 1.3328 Soln25 1.3323 Sola 0.0000 Solb 0.0000 Solg 0.0000 Solc 0.0000 Solh 0.0000 Calculating surface done! ( 0.0s) GEPOL surface points 3091 GEPOL Volume 2774.5370 GEPOL Surface-area 1578.9293 Calculating surface distance matrix done! ( 0.2s) Performing Cholesky decomposition & store done! ( 0.8s) Overall time for CPCM initialization 1.0s -1384.99596502 2866.67652312 -4251.67248814 -7583.36341563 3331.69092750 -0.04999542 -2764.23543922 1379.23947420 2.00417367 107.999907555660 107.999907555660 215.999815111319 -132.288008170448 0 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 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 217 218 219 220 221 222 223 224 225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 245 246 247 248 249 250 251 252 253 254 255 256 257 258 259 260 261 262 263 264 265 266 267 268 269 270 271 272 273 274 275 276 277 278 279 280 281 282 283 284 285 286 287 288 289 290 291 292 293 294 295 296 297 298 299 300 301 302 303 304 305 306 307 308 309 310 311 312 313 314 315 316 317 318 319 320 321 322 323 324 325 326 327 328 329 330 331 332 333 334 335 336 337 338 339 340 341 342 343 344 345 346 347 348 349 350 351 352 353 354 355 356 357 358 359 360 361 362 363 364 365 366 367 368 369 370 371 372 373 374 375 376 377 378 379 380 381 382 383 384 385 386 387 388 389 390 391 392 393 394 395 396 397 398 399 400 401 402 403 404 405 406 407 408 409 410 411 412 413 414 415 416 417 418 419 420 421 422 423 424 425 426 427 428 429 430 431 432 433 434 435 436 437 438 439 440 441 442 443 444 445 446 447 448 449 450 451 452 453 454 455 456 457 458 459 460 461 462 463 464 465 466 467 468 469 470 471 472 473 474 475 476 477 478 479 480 481 482 483 484 485 486 487 488 489 490 491 492 493 494 495 496 497 498 499 500 501 502 503 504 505 506 507 508 509 510 511 512 513 514 515 516 517 518 519 520 521 522 523 524 525 526 527 528 529 530 531 532 533 534 535 536 537 538 539 540 541 542 543 544 545 546 547 548 549 550 551 552 553 554 555 556 557 558 559 560 561 562 563 564 565 566 567 568 569 570 571 572 573 574 575 576 577 578 579 580 581 582 583 584 585 586 587 588 589 590 591 592 593 594 595 596 597 598 599 600 601 602 603 604 605 606 607 608 609 610 611 612 613 614 615 616 617 618 619 620 621 622 623 624 625 626 627 628 629 630 631 632 633 634 635 636 637 638 639 640 641 642 643 644 645 646 647 648 649 650 651 652 653 654 655 656 657 658 659 660 661 662 663 664 665 666 667 668 669 670 671 672 673 674 675 676 677 678 679 680 681 682 683 684 685 686 687 688 689 690 691 692 693 694 695 696 697 698 699 700 701 702 703 704 705 706 707 708 709 710 711 712 713 714 715 716 717 718 719 720 721 722 723 724 725 726 727 728 729 730 731 732 733 734 735 736 737 738 739 740 741 742 743 744 745 746 747 748 749 750 751 752 753 754 755 756 757 758 759 760 761 762 763 764 765 766 767 768 769 770 771 772 773 774 775 776 777 778 779 780 781 782 783 784 785 786 787 788 789 790 791 792 793 794 795 796 797 798 799 800 801 802 803 804 805 806 807 808 809 810 811 812 813 814 815 816 817 818 819 820 821 822 823 824 825 826 827 828 829 830 831 832 833 834 835 836 837 838 839 840 841 842 843 844 845 846 847 848 849 850 851 852 853 854 855 856 857 858 859 860 861 862 863 864 865 866 867 868 869 870 871 872 873 874 875 876 877 878 879 880 881 882 883 884 885 886 887 888 889 890 891 892 893 894 895 896 897 898 899 900 901 902 903 904 905 906 907 908 909 910 911 912 913 914 915 916 917 918 919 920 921 922 923 924 925 926 927 928 929 930 931 932 933 934 935 936 937 938 939 940 941 942 943 944 945 946 947 948 949 950 951 952 953 954 955 956 957 958 959 960 961 962 963 964 965 966 967 968 969 970 971 972 973 974 975 976 977 978 979 980 981 982 983 984 985 986 987 988 989 990 991 992 993 994 995 996 997 998 999 1000 1001 1002 1003 1004 1005 1006 1007 1008 1009 1010 1011 1012 1013 1014 1015 1016 1017 1018 1019 1020 1021 1022 1023 1024 1025 1026 1027 1028 1029 1030 1031 1032 1033 1034 1035 1036 1037 1038 1039 1040 1041 1042 1043 1044 1045 1046 1047 1048 1049 1050 1051 1052 1053 1054 1055 1056 1057 1058 1059 1060 1061 1062 1063 1064 1065 1066 1067 1068 1069 1070 1071 1072 1073 1074 1075 1076 1077 1078 1079 1080 1081 1082 1083 1084 1085 1086 1087 1088 1089 1090 1091 1092 1093 1094 1095 1096 1097 1098 1099 1100 1101 1102 1103 1104 1105 1106 1107 1108 1109 1110 1111 1112 1113 1114 1115 1116 1117 1118 1119 1120 1121 1122 1123 1124 1125 1126 1127 1128 1129 1130 1131 1132 1133 1134 1135 1136 1137 1138 1139 1140 1141 1142 1143 1144 1145 1146 1147 1148 1149 1150 1151 1152 1153 1154 1155 1156 1157 1158 1159 1160 1161 1162 1163 1164 1165 1166 1167 1168 1169 1170 1171 1172 1173 1174 1175 1176 1177 1178 1179 1180 1181 1182 1183 1184 1185 1186 1187 1188 1189 1190 1191 1192 1193 1194 1195 1196 1197 1198 1199 1200 1201 1202 1203 1204 1205 1206 1207 1208 1209 1210 1211 1212 1213 1214 1215 1216 1217 1218 1219 1220 1221 1222 1223 1224 1225 1226 1227 1228 1229 1230 1231 1232 1233 1234 1235 1236 1237 1238 1239 1240 1241 1242 1243 1244 1245 1246 1247 1248 1249 1250 1251 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -525.1062 -524.5352 -522.9358 -395.5592 -394.5463 -394.4408 -394.2256 -393.5462 -393.3771 -392.4777 -284.1527 -282.1966 -282.0947 -281.6402 -281.6378 -281.1298 -280.9578 -280.6970 -280.3522 -280.2053 -279.9298 -279.9175 -279.8388 -279.8197 -279.7894 -279.7835 -279.7389 -279.1576 -279.1503 -279.1429 -34.9557 -34.0008 -33.7724 -31.2200 -30.1262 -29.6050 -28.6012 -28.3198 -27.2447 -26.7248 -25.4605 -25.2040 -24.4521 -24.0208 -23.6786 -23.6400 -22.5632 -21.9296 -21.9165 -21.4607 -21.3117 -21.2124 -20.0767 -19.8570 -19.6917 -19.6027 -18.8890 -18.2444 -17.6554 -17.5677 -17.4918 -17.2736 -16.9075 -16.5748 -16.3758 -16.2752 -16.2081 -15.8934 -15.8409 -15.3924 -15.2280 -15.1736 -14.9590 -14.9215 -14.5658 -14.4892 -14.2910 -14.2351 -14.0967 -14.0116 -13.9696 -13.5114 -13.4488 -13.2387 -13.1786 -13.0941 -13.0353 -12.8323 -12.4618 -12.3810 -12.3451 -12.1771 -12.0026 -11.7608 -11.6184 -11.4848 -11.2868 -11.2096 -10.9598 -10.8427 -10.6396 -10.4877 -10.3194 -10.0976 -9.7661 -9.4635 -9.1052 -8.7417 0.3099 1.0349 1.4695 1.5067 1.6177 2.1595 3.0427 3.3714 3.6011 3.7693 3.8233 4.0374 4.3057 4.3745 4.4746 4.6005 4.7101 4.8120 4.8947 4.9459 5.1156 5.1639 5.2560 5.2805 5.3576 5.4014 5.6516 5.7290 5.8532 5.8972 6.0131 6.1112 6.1600 6.2615 6.4324 6.4797 6.5889 6.6286 6.6798 6.8032 6.9011 6.9814 7.1303 7.2253 7.2430 7.2756 7.3235 7.4569 7.6811 7.7937 7.8568 7.8842 8.0775 8.0894 8.2089 8.2546 8.3835 8.4668 8.6024 8.6727 8.7998 8.9205 9.0388 9.2555 9.3535 9.4234 9.5245 9.6166 9.7489 9.8088 9.8568 9.9802 10.1159 10.1804 10.2767 10.3413 10.3936 10.5540 10.6118 10.6786 10.7613 10.9050 11.0435 11.1532 11.2703 11.3646 11.5132 11.6003 11.6502 11.6954 11.9004 11.9067 11.9765 12.0972 12.1343 12.1902 12.3024 12.3780 12.4495 12.4555 12.6388 12.7113 12.8449 12.9882 13.1022 13.2192 13.4200 13.4427 13.4761 13.5238 13.6410 13.7581 13.8158 13.9260 13.9530 14.0369 14.1353 14.1855 14.3509 14.4066 14.4625 14.5177 14.5375 14.5809 14.7089 14.7787 14.8483 15.0111 15.0280 15.0994 15.2063 15.2618 15.2923 15.4307 15.5238 15.5581 15.5931 15.7950 15.8461 15.9506 16.0221 16.0751 16.1406 16.2131 16.4939 16.5416 16.5687 16.6323 16.7432 16.9789 17.1221 17.2618 17.4759 17.5416 17.6423 17.7077 17.8249 17.8613 17.9745 18.0897 18.2326 18.3388 18.4925 18.6564 18.7872 18.9165 19.0602 19.2644 19.3847 19.5762 19.7226 19.7648 19.8672 19.8933 20.2038 20.3065 20.3762 20.4688 20.6637 20.7441 20.8567 20.8895 21.0153 21.0812 21.2221 21.2945 21.3576 21.4483 21.5432 21.6383 21.7717 21.8197 22.0047 22.1264 22.3520 22.5223 22.6527 22.7115 22.9364 22.9964 23.1451 23.1866 23.4265 23.4939 23.6388 23.7151 23.8046 24.0176 24.0390 24.1668 24.2021 24.3105 24.3794 24.4554 24.7685 24.9343 24.9824 25.2683 25.4261 25.4515 25.5817 25.6633 25.7191 25.8127 26.1121 26.3467 26.4418 26.6084 26.8539 26.9518 27.1480 27.2445 27.3380 27.4070 27.5342 27.6966 27.7936 28.0602 28.1241 28.2570 28.4336 28.5400 28.6041 28.9090 28.9707 29.0076 29.0873 29.1728 29.2312 29.4009 29.4399 29.5511 29.7145 29.7855 29.8957 30.1138 30.2881 30.3805 30.4615 30.6186 30.7387 30.8511 31.0938 31.2814 31.3417 31.3963 31.5780 31.7155 31.9189 31.9985 32.1745 32.4215 32.4600 32.5753 32.6783 32.7225 32.8879 32.9748 33.2224 33.3408 33.5722 33.6784 33.7315 33.8934 33.9985 34.1227 34.3139 34.4484 34.5544 34.6171 34.8506 34.9815 35.1129 35.2169 35.2851 35.3608 35.4722 35.7330 35.8424 36.0832 36.1755 36.2511 36.4036 36.5370 36.7954 36.9511 36.9949 37.2211 37.4001 37.5427 37.5874 37.8240 37.8959 38.0721 38.1753 38.2613 38.4231 38.4820 38.5634 38.6441 38.7512 38.7829 38.9547 39.1754 39.2958 39.3765 39.5801 39.7123 39.8365 40.0066 40.0259 40.0581 40.2537 40.3575 40.5203 40.5564 40.8053 40.8566 40.9293 41.0758 41.2174 41.2264 41.6316 41.6832 41.8352 41.9083 41.9544 42.1664 42.2881 42.4078 42.6000 42.6796 42.7218 42.9214 43.0258 43.0762 43.1765 43.3164 43.4088 43.5118 43.5645 43.7056 43.7736 43.9359 44.2052 44.3126 44.3516 44.4737 44.5114 44.5698 44.6943 44.9857 45.1107 45.1448 45.3733 45.4103 45.5686 45.6976 45.7937 45.9362 45.9496 46.0803 46.2300 46.4020 46.5477 46.6108 46.7855 47.0571 47.0872 47.3119 47.4485 47.5790 47.7058 47.7984 47.8913 48.0338 48.1121 48.4194 48.6362 48.6713 48.7966 48.9499 49.0110 49.2159 49.2317 49.4288 49.4896 49.6684 50.0452 50.1163 50.2681 50.3175 50.4979 50.6035 50.8840 50.9659 51.1798 51.3846 51.7753 52.0480 52.1074 52.3383 52.4729 52.8352 53.2063 53.2176 53.4619 53.7755 54.1424 54.4994 54.6785 54.8288 54.9252 55.0328 55.5767 55.7194 55.7967 55.9316 56.4422 56.7283 56.7686 57.0726 57.1788 57.2029 57.3797 57.5322 57.5739 57.9314 57.9541 58.0386 58.2135 58.3575 58.6277 58.8515 58.9390 59.2850 59.3121 59.7541 59.8657 60.0469 60.2362 60.2510 60.3920 60.8016 60.9643 61.1972 61.5555 61.8173 62.0886 62.2026 62.4773 62.5842 62.7360 62.7901 63.1383 63.3756 63.7675 63.8648 64.1107 64.2099 64.5779 65.0050 65.1998 65.3076 65.6687 65.7895 65.9871 66.5818 66.7036 66.8699 66.9374 67.2540 67.3819 67.5741 67.6081 67.9617 68.1088 68.3158 68.5091 68.5551 68.8656 68.9091 69.2869 69.5771 69.6970 69.7795 69.8392 70.3132 70.5093 70.7502 70.8731 70.9996 71.1845 71.2846 71.5994 71.7238 71.9738 72.2322 72.5419 72.7596 73.1789 73.3072 73.4951 73.7389 73.7798 74.0435 74.1433 74.5557 74.9024 74.9409 75.1653 75.5724 75.7453 75.9768 76.0831 76.1653 76.3388 76.5007 76.5159 76.6921 76.8839 77.0168 77.3002 77.3759 77.4270 77.5390 77.5715 77.9829 78.0342 78.2069 78.2642 78.4943 78.6550 78.9320 79.1239 79.2030 79.3077 79.3678 79.3913 79.4862 79.6027 79.6879 79.8026 79.9884 80.0365 80.1656 80.3177 80.4034 80.5208 80.8214 80.9174 81.0641 81.2186 81.2771 81.5188 81.6456 81.9001 82.2475 82.3310 82.5506 82.6524 82.8667 82.8805 82.9922 83.0520 83.2595 83.4033 83.5363 83.7491 83.8327 83.9547 84.0819 84.2289 84.3332 84.4579 84.5304 84.7188 84.8038 84.9301 85.0515 85.1323 85.2332 85.3022 85.3615 85.4793 85.6846 85.7306 85.8640 85.9356 86.0838 86.1395 86.2521 86.2910 86.3708 86.6228 86.7363 86.9087 87.0966 87.1366 87.3076 87.5777 87.6811 87.7192 87.9150 88.0434 88.1416 88.2807 88.3379 88.4067 88.4743 88.6655 88.7996 88.9322 89.0131 89.0579 89.2034 89.3517 89.5441 89.6335 89.7456 89.8699 89.8978 90.0964 90.1814 90.4087 90.5517 90.7536 90.9500 91.0386 91.2602 91.3214 91.5834 91.6619 91.7385 91.8704 91.9146 91.9699 92.1485 92.1746 92.2953 92.5611 92.6321 92.7152 92.7874 93.0123 93.2060 93.2354 93.2781 93.3758 93.4519 93.5777 93.6851 93.7979 93.9731 94.0009 94.1387 94.2163 94.3267 94.5474 94.7076 94.8419 94.9618 95.1722 95.2472 95.2793 95.3977 95.5501 95.8263 95.9756 96.0954 96.1625 96.3791 96.6352 96.6697 96.8162 96.9272 97.0249 97.1278 97.2224 97.2746 97.3911 97.5070 97.5783 97.7551 97.7992 98.0188 98.1050 98.2996 98.4253 98.4720 98.5772 98.6740 98.8388 98.8697 99.1279 99.2214 99.3379 99.3846 99.5725 99.8577 99.9714 100.1448 100.2260 100.4441 100.5423 101.1549 101.2965 101.4265 101.6153 101.7152 101.7455 102.0020 102.3113 102.4717 102.6439 102.8017 102.8585 103.0354 103.2113 103.3206 103.3612 103.5025 103.6383 103.8658 103.9497 104.2014 104.2539 104.3872 104.5858 104.6896 104.8666 104.9589 105.1332 105.2256 105.4225 105.4929 105.6353 105.6540 105.7088 105.8345 105.9134 106.2423 106.3859 106.4381 106.5181 106.6827 106.8529 106.9707 107.2580 107.3833 107.6640 107.7201 107.8384 107.8449 108.0080 108.2748 108.3705 108.4710 108.6294 108.7740 108.8402 108.9415 109.0890 109.2714 109.5310 109.5912 109.6364 109.7371 110.0448 110.1874 110.3107 110.5187 110.5887 110.7872 111.0379 111.2180 111.3305 111.4286 111.4490 111.5227 111.8508 112.1397 112.2475 112.4479 112.6324 112.6702 112.9833 113.1692 113.3735 113.4437 113.5343 113.6998 113.8935 113.9223 114.2379 114.3955 114.4507 114.6922 114.7740 114.8993 115.0421 115.0569 115.1127 115.2106 115.3334 115.5976 115.6878 115.7597 115.9459 115.9717 116.0869 116.1517 116.4276 116.4516 116.5367 116.7422 116.8404 116.9667 117.0401 117.3038 117.3638 117.6236 117.7683 117.9414 117.9849 118.1651 118.2463 118.3290 118.4525 118.6302 118.7497 118.8862 119.0920 119.1736 119.4523 119.4831 119.8461 120.1884 120.3612 120.4982 120.7329 120.9179 120.9981 121.2053 121.4942 121.6611 121.8894 122.1380 122.2696 122.2803 122.3012 122.4889 122.5274 122.6994 123.1128 123.2919 123.4451 123.6708 124.1253 124.4842 124.8471 125.1037 125.1810 125.5515 125.6693 126.0433 126.4615 126.5975 126.9138 126.9182 127.2308 127.6710 127.8388 128.2544 128.3902 128.4999 128.6000 128.7797 128.8748 129.0511 129.2157 129.2532 129.2795 129.4351 129.6428 129.7382 129.8837 129.9747 130.2007 130.2329 130.3764 130.4930 130.6078 130.7266 130.9048 130.9674 131.0062 131.1713 131.5741 131.8961 132.0057 132.1245 132.3159 132.4680 132.5188 132.7561 132.9303 133.0364 133.2821 133.4194 133.5404 133.7614 133.9062 133.9765 134.3864 134.4896 134.5030 134.8100 134.8573 134.9986 135.2673 135.6099 135.7170 135.9553 136.3167 136.6590 137.0197 137.1174 137.4528 137.6546 137.7522 137.8614 138.0974 138.4613 138.5284 138.6983 138.7934 139.3692 139.7636 140.0715 140.2636 140.5088 140.5739 140.8571 141.0357 141.4792 141.8681 141.9340 141.9975 142.3903 142.5324 142.6411 142.6857 142.8929 142.9570 143.0489 143.2912 143.8467 144.3007 144.3729 144.4484 144.5611 144.8626 145.0279 145.1071 145.2283 145.3767 145.5620 145.6329 145.9177 145.9731 146.1206 146.4246 146.5858 146.6707 146.9715 147.0857 147.2956 147.3718 147.7169 147.9353 148.2049 148.2894 148.4618 148.4969 148.6802 148.7405 148.8716 148.9893 149.0688 149.1857 149.2229 149.6360 149.7208 149.7675 149.8482 150.1846 150.2767 150.5728 150.6006 150.7196 150.9194 151.3348 151.5417 151.9144 151.9788 152.3117 152.3734 152.5239 152.6978 153.2227 153.3795 153.4360 154.1382 154.7736 154.9202 155.0525 155.2676 155.4400 155.7227 155.8044 156.0258 156.2491 156.4513 156.7333 156.9841 157.2441 157.3634 157.6985 158.0067 158.3851 158.4920 158.5908 158.6581 158.9127 159.0352 159.2002 159.9263 160.0134 160.1330 160.5097 161.0961 161.8280 161.9396 162.1740 162.6062 163.4716 163.6967 163.9282 164.4959 165.8116 166.1065 166.4550 166.9523 167.7693 168.5591 169.2460 169.8807 170.0079 170.9320 171.1218 172.1630 172.2897 172.8719 172.9009 175.2682 177.3362 177.4511 178.6935 179.5733 180.7868 181.4087 182.0727 183.3315 185.1091 185.7643 186.4448 187.3187 187.8260 187.9518 188.5840 188.7986 191.1194 191.8750 193.6205 195.9128 196.5810 196.8162 198.0593 200.8000 203.5350 207.7920 208.8277 216.4411 619.2478 622.4237 625.6825 631.4228 632.5192 633.7923 634.4238 634.7844 636.3403 637.8157 638.1935 640.0313 640.9387 646.4631 646.6934 648.3599 648.5820 649.0215 651.9220 659.2633 872.4784 873.0623 882.8638 885.0537 893.2868 900.2872 904.8820 1198.4102 1208.5285 1215.1214 0.0000000 0 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 O O O N N N N N N N C C C C C C C C C C C C C C C C C C C C H H H H H H H H H H H H H H H H H H H H H H H -0.340057 -0.215960 -0.528715 -0.152896 -0.413253 0.106162 -0.159974 -0.218650 -0.173873 -0.139306 0.272881 -0.312398 -0.282400 -0.312265 0.538253 0.308419 0.143239 0.292441 0.067342 0.041663 -0.234021 0.077856 -0.207711 -0.098144 -0.214938 -0.234607 -0.166402 -0.148187 -0.148446 -0.119319 0.105094 0.101122 0.104961 0.103277 0.103353 0.095464 0.105172 0.101644 0.104986 0.179312 0.117102 0.113481 0.159470 0.151626 0.163749 0.155094 0.151782 0.159970 0.161349 0.162429 0.126809 0.120870 0.125146 0 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 O O O N N N N N N N C C C C C C C C C C C C C C C C C C C C H H H H H H H H H H H H H H H H H H H H H H H 8.3401 8.2160 8.5287 7.1529 7.4133 6.8938 7.1600 7.2186 7.1739 7.1393 5.7271 6.3124 6.2824 6.3123 5.4617 5.6916 5.8568 5.7076 5.9327 5.9583 6.2340 5.9221 6.2077 6.0981 6.2149 6.2346 6.1664 6.1482 6.1484 6.1193 0.8949 0.8989 0.8950 0.8967 0.8966 0.9045 0.8948 0.8984 0.8950 0.8207 0.8829 0.8865 0.8405 0.8484 0.8363 0.8449 0.8482 0.8400 0.8387 0.8376 0.8732 0.8791 0.8749 8.0000 8.0000 8.0000 7.0000 7.0000 7.0000 7.0000 7.0000 7.0000 7.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 -0.3401 -0.2160 -0.5287 -0.1529 -0.4133 0.1062 -0.1600 -0.2186 -0.1739 -0.1393 0.2729 -0.3124 -0.2824 -0.3123 0.5383 0.3084 0.1432 0.2924 0.0673 0.0417 -0.2340 0.0779 -0.2077 -0.0981 -0.2149 -0.2346 -0.1664 -0.1482 -0.1484 -0.1193 0.1051 0.1011 0.1050 0.1033 0.1034 0.0955 0.1052 0.1016 0.1050 0.1793 0.1171 0.1135 0.1595 0.1516 0.1637 0.1551 0.1518 0.1600 0.1613 0.1624 0.1268 0.1209 0.1251 2.1131 1.9889 1.9717 3.1855 3.0095 3.4042 2.8749 2.9858 2.8151 2.8472 3.7946 3.9039 3.9124 3.9090 4.2548 4.0142 3.8082 3.6966 3.4754 3.9409 3.9249 4.2774 3.8989 3.9372 3.9813 3.9830 3.9154 3.8886 3.8946 3.8411 1.0059 1.0205 1.0029 1.0071 1.0072 1.0060 1.0027 1.0196 1.0065 1.0302 0.9972 1.0050 1.0255 0.9940 0.9909 0.9976 1.0075 0.9920 0.9908 0.9885 0.9976 0.9933 1.0074 2.1131 1.9889 1.9717 3.1855 3.0095 3.4042 2.8749 2.9858 2.8151 2.8472 3.7946 3.9039 3.9124 3.9090 4.2548 4.0142 3.8082 3.6966 3.4754 3.9409 3.9249 4.2774 3.8989 3.9372 3.9813 3.9830 3.9154 3.8886 3.8946 3.8411 1.0059 1.0205 1.0029 1.0071 1.0072 1.0060 1.0027 1.0196 1.0065 1.0302 0.9972 1.0050 1.0255 0.9940 0.9909 0.9976 1.0075 0.9920 0.9908 0.9885 0.9976 0.9933 1.0074 -0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 0.8355 1.2127 0.9084 0.9284 1.7854 1.2025 1.0628 0.9366 1.4635 1.3947 1.1091 1.2959 0.8808 1.7623 1.2025 1.6541 1.4586 0.1099 0.9595 0.9456 0.9624 0.9870 0.9904 0.9804 0.9898 0.9900 0.9860 0.9806 0.9888 0.9876 1.3572 0.9287 1.4037 0.8677 1.0919 1.3270 1.3260 0.9675 1.0229 1.4654 0.9541 1.3788 0.9865 0.9772 1.4651 0.9789 1.4521 0.9919 1.3990 0.9855 1.4047 0.9826 0.9793 0.9707 0.9691 0.9756 0 10 0 14 1 6 1 19 2 14 3 14 3 15 3 39 4 15 4 16 5 8 5 21 5 29 6 17 7 9 7 21 8 9 8 21 10 11 10 12 10 13 11 30 11 31 11 32 12 33 12 34 12 35 13 36 13 37 13 38 15 20 16 19 16 22 17 18 17 21 18 24 18 25 19 40 19 41 20 23 20 42 22 23 22 43 23 44 24 26 24 45 25 27 25 46 26 28 26 47 27 28 27 48 28 49 29 50 29 51 29 52 -0.026035270 -1385.022000287162 -29.24132 29.17051 -0.07081 4.41209 -5.05879 -0.64670 -10.21675 7.30298 -2.91377 2.98551 7.58857