Orca 5.0.2 RELEASE 1 2 3 4 5 14s9p3d1f 11s6p2d1f 11s6p2d1f 11s6p2d1f 5s2p1d 5s5p3d1f 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 53 54 55 56 57 S O O O 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 H H H H H H H H H 1 2 2 2 3 3 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 348.29059999999976 AuxInfo=1/0/N:24,25,11,12,26,21,22,19,20,15,13,16,17,18,8,9,14,10,23,7,6,5,4,3,2,1/E:(1,2)(3,4)(6,7)(8,9)(13,14)/CRV:10.3,11.3,12.3,16.3,17.3,18.3,19.3,23.1/rA:58nSOOO1NNCCC3C3CCC3C3C3C3CCCCCCC3CCCHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;s1;s1;s2;s7;s8;s2s9;s7;s7;s9;s3s10;s13;s14s15;s5;s5;s17;s18;s19;s20;s3s4s6;s21;s22;s6;s8;s8;s11;s11;s11;s12;s12;s12;s13;s15;s16;s17;s17;s18;s18;s19;s19;s20;s20;s21;s21;s22;s22;s24;s24;s24;s25;s25;s25;s26;s26;s26;/rC:-1.3762,2.3393,.7665;.9319,-1.6194,-.0087;.9021,.82,1.431;-.0583,-.5916,2.8929;-1.636,1.6426,-.6945;-1.2658,1.0861,1.9495;1.2489,-2.9591,-.5058;2.7861,-3.086,-.3712;3.1388,-1.9282,.5109;2.0051,-1.1444,.6383;.7706,-3.0352,-1.9396;.5272,-3.9489,.3905;4.32,-1.5455,1.1191;2.0233,.0266,1.3742;4.3465,-.3638,1.8563;3.2036,.4167,1.9861;-2.9819,1.3477,-1.1684;-.5268,1.3609,-1.5965;-3.2074,-.1047,-1.5702;-.5718,2.1791,-2.8822;-2.9933,-1.1071,-.4466;-.566,3.6829,-2.6451;-.1407,.357,2.1487;-3.2919,-2.5363,-.8729;-.5282,4.4837,-3.9376;-2.4435,.6994,2.7142;3.2829,-3.0057,-1.3421;3.0699,-4.0493,.0558;-.3095,-2.8933,-2.0096;1.0038,-4.0147,-2.3584;1.2583,-2.282,-2.5602;.7184,-4.9689,.0546;-.5522,-3.7878,.3708;.8665,-3.8699,1.4253;5.2136,-2.1489,1.0206;5.2617,-.0478,2.3388;3.2263,1.3344,2.5605;-3.2194,1.9911,-2.0236;-3.6821,1.6196,-.3774;-.4983,.2934,-1.8409;.4001,1.5806,-1.0686;-4.237,-.1785,-1.9353;-2.5741,-.3643,-2.4249;.3034,1.8965,-3.4761;-1.4417,1.9012,-3.4863;-3.6334,-.8408,.3998;-1.964,-1.0446,-.0824;-1.4511,3.9697,-2.0704;.297,3.9478,-2.0256;-2.6541,-2.8488,-1.7025;-4.328,-2.6467,-1.2003;-3.1319,-3.2389,-.0536;-.5309,5.5571,-3.7413;-1.393,4.2646,-4.5676;.3672,4.2604,-4.5212;-2.7467,-.3269,2.5088;-3.2632,1.3583,2.4431;-2.2675,.8023,3.7853; 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 1628 RIJ-COSX (HFX calculated with COS-X)) on IntName inp HFTyp RHF Charge 0 Mult 1 NEL 206 Dim 1265 ENuc 2812.8303620558 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 5.494e-06 Time for diagonalization 0.557 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.274 sec Total time needed 0.838 sec 16 8 8 8 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 1 1 1 1 1 1 1 1 1 348.29059999999976 AuxInfo=1/0/N:24,25,11,12,26,21,22,19,20,15,13,16,17,18,8,9,14,10,23,7,6,5,4,3,2,1/E:(1,2)(3,4)(6,7)(8,9)(13,14)/CRV:10.3,11.3,12.3,16.3,17.3,18.3,19.3,23.1/rA:58nSOOO1NNCCC3C3CCC3C3C3C3CCCCCCC3CCCHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;s1;s1;s2;s7;s8;s2s9;s7;s7;s9;s3s10;s13;s14s15;s5;s5;s17;s18;s19;s20;s3s4s6;s21;s22;s6;s8;s8;s11;s11;s11;s12;s12;s12;s13;s15;s16;s17;s17;s18;s18;s19;s19;s20;s20;s21;s21;s22;s22;s24;s24;s24;s25;s25;s25;s26;s26;s26;/rC:-1.3762,2.3393,.7665;.9319,-1.6194,-.0087;.9021,.82,1.431;-.0583,-.5916,2.8929;-1.636,1.6426,-.6945;-1.2658,1.0861,1.9495;1.2489,-2.9591,-.5058;2.7861,-3.086,-.3712;3.1388,-1.9282,.5109;2.0051,-1.1444,.6383;.7706,-3.0352,-1.9396;.5272,-3.9489,.3905;4.32,-1.5455,1.1191;2.0233,.0266,1.3742;4.3465,-.3638,1.8563;3.2036,.4167,1.9861;-2.9819,1.3477,-1.1684;-.5268,1.3609,-1.5965;-3.2074,-.1047,-1.5702;-.5718,2.1791,-2.8822;-2.9933,-1.1071,-.4466;-.566,3.6829,-2.6451;-.1407,.357,2.1487;-3.2919,-2.5363,-.8729;-.5282,4.4837,-3.9376;-2.4435,.6994,2.7142;3.2829,-3.0057,-1.3421;3.0699,-4.0493,.0558;-.3095,-2.8933,-2.0096;1.0038,-4.0147,-2.3584;1.2583,-2.282,-2.5602;.7184,-4.9689,.0546;-.5522,-3.7878,.3708;.8665,-3.8699,1.4253;5.2136,-2.1489,1.0206;5.2617,-.0478,2.3388;3.2263,1.3344,2.5605;-3.2194,1.9911,-2.0236;-3.6821,1.6196,-.3774;-.4983,.2934,-1.8409;.4001,1.5806,-1.0686;-4.237,-.1785,-1.9353;-2.5741,-.3643,-2.4249;.3034,1.8965,-3.4761;-1.4417,1.9012,-3.4863;-3.6334,-.8408,.3998;-1.964,-1.0446,-.0824;-1.4511,3.9697,-2.0704;.297,3.9478,-2.0256;-2.6541,-2.8488,-1.7025;-4.328,-2.6467,-1.2003;-3.1319,-3.2389,-.0536;-.5309,5.5571,-3.7413;-1.393,4.2646,-4.5676;.3672,4.2604,-4.5212;-2.7467,-.3269,2.5088;-3.2632,1.3583,2.4431;-2.2675,.8023,3.7853; 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 "1-OCTANOL" 348.29059999999976 AuxInfo=1/0/N:24,25,11,12,26,21,22,19,20,15,13,16,17,18,8,9,14,10,23,7,6,5,4,3,2,1/E:(1,2)(3,4)(6,7)(8,9)(13,14)/CRV:10.3,11.3,12.3,16.3,17.3,18.3,19.3,23.1/rA:58nSOOO1NNCCC3C3CCC3C3C3C3CCCCCCC3CCCHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;s1;s1;s2;s7;s8;s2s9;s7;s7;s9;s3s10;s13;s14s15;s5;s5;s17;s18;s19;s20;s3s4s6;s21;s22;s6;s8;s8;s11;s11;s11;s12;s12;s12;s13;s15;s16;s17;s17;s18;s18;s19;s19;s20;s20;s21;s21;s22;s22;s24;s24;s24;s25;s25;s25;s26;s26;s26;/rC:-1.3762,2.3393,.7665;.9319,-1.6194,-.0087;.9021,.82,1.431;-.0583,-.5916,2.8929;-1.636,1.6426,-.6945;-1.2658,1.0861,1.9495;1.2489,-2.9591,-.5058;2.7861,-3.086,-.3712;3.1388,-1.9282,.5109;2.0051,-1.1444,.6383;.7706,-3.0352,-1.9396;.5272,-3.9489,.3905;4.32,-1.5455,1.1191;2.0233,.0266,1.3742;4.3465,-.3638,1.8563;3.2036,.4167,1.9861;-2.9819,1.3477,-1.1684;-.5268,1.3609,-1.5965;-3.2074,-.1047,-1.5702;-.5718,2.1791,-2.8822;-2.9933,-1.1071,-.4466;-.566,3.6829,-2.6451;-.1407,.357,2.1487;-3.2919,-2.5363,-.8729;-.5282,4.4837,-3.9376;-2.4435,.6994,2.7142;3.2829,-3.0057,-1.3421;3.0699,-4.0493,.0558;-.3095,-2.8933,-2.0096;1.0038,-4.0147,-2.3584;1.2583,-2.282,-2.5602;.7184,-4.9689,.0546;-.5522,-3.7878,.3708;.8665,-3.8699,1.4253;5.2136,-2.1489,1.0206;5.2617,-.0478,2.3388;3.2263,1.3344,2.5605;-3.2194,1.9911,-2.0236;-3.6821,1.6196,-.3774;-.4983,.2934,-1.8409;.4001,1.5806,-1.0686;-4.237,-.1785,-1.9353;-2.5741,-.3643,-2.4249;.3034,1.8965,-3.4761;-1.4417,1.9012,-3.4863;-3.6334,-.8408,.3998;-1.964,-1.0446,-.0824;-1.4511,3.9697,-2.0704;.297,3.9478,-2.0256;-2.6541,-2.8488,-1.7025;-4.328,-2.6467,-1.2003;-3.1319,-3.2389,-.0536;-.5309,5.5571,-3.7413;-1.393,4.2646,-4.5676;.3672,4.2604,-4.5212;-2.7467,-.3269,2.5088;-3.2632,1.3583,2.4431;-2.2675,.8023,3.7853; Epsilon 9.8629 Refrac 1.4295 Rsolv 1.3000 Surface type GAUSSIAN VDW Epsilon function type CPCM S O N C H 2.4900 1.6280 1.8900 1.8500 1.2000 Solvent: 1-OCTANOL Soln 1.4295 Soln25 1.4279 Sola 0.3700 Solb 0.4800 Solg 39.0100 Solc 0.0000 Solh 0.0000 Calculating surface done! ( 0.0s) GEPOL surface points 3357 GEPOL Volume 2779.9670 GEPOL Surface-area 1567.8124 Calculating surface distance matrix done! ( 0.2s) Performing Cholesky decomposition & store done! ( 0.9s) Overall time for CPCM initialization 1.1s -1514.92463860 2812.83036206 -4327.75500065 -7664.83220066 3337.07720001 -0.02635199 -3024.02787425 1509.10323565 2.00385752 103.000145493017 103.000145493017 206.000290986034 -129.020331034433 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 1252 1253 1254 1255 1256 1257 1258 1259 1260 1261 1262 1263 1264 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 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -2421.4624 -524.8941 -524.1699 -522.9015 -393.5923 -392.9417 -283.9657 -281.4972 -281.3865 -281.2215 -280.1997 -280.1546 -280.0887 -279.8613 -279.7960 -279.7442 -279.6998 -279.6231 -279.2197 -279.2101 -279.1915 -279.1830 -279.1820 -279.1672 -279.0028 -278.9960 -219.7874 -164.1812 -164.0360 -163.8019 -34.0868 -32.5894 -31.3487 -29.3231 -28.2758 -26.6827 -25.3745 -24.7749 -24.5993 -24.2125 -23.6352 -23.1877 -22.9388 -22.2965 -21.9428 -21.8030 -21.4248 -20.5181 -20.1722 -19.6601 -19.4017 -18.7009 -18.5414 -18.4202 -18.1254 -17.3538 -16.8186 -16.6037 -16.1967 -15.8981 -15.8073 -15.7216 -15.6291 -15.4898 -15.0255 -14.8953 -14.8143 -14.6040 -14.5093 -14.2787 -14.0665 -14.0327 -13.8978 -13.7610 -13.6383 -13.5906 -13.4774 -13.1892 -13.1181 -12.9341 -12.8575 -12.6347 -12.5992 -12.5166 -12.3011 -12.1809 -12.0948 -12.0114 -11.7411 -11.5493 -11.4864 -11.4240 -11.3429 -11.2321 -11.1879 -11.0972 -11.0602 -10.8954 -9.7775 -9.2301 -8.8199 -8.6261 -8.2419 1.6606 2.1233 2.5594 2.8473 2.9628 3.3926 3.5656 3.6484 3.9213 3.9631 4.0183 4.1397 4.4619 4.5325 4.6079 4.7138 4.7931 4.9669 4.9881 5.0872 5.2338 5.2978 5.3532 5.4197 5.5027 5.6441 5.7325 5.8050 5.8198 5.9324 5.9822 6.0566 6.1907 6.2822 6.3568 6.4359 6.5354 6.6061 6.7510 6.7785 6.8318 6.9858 7.0186 7.1615 7.3047 7.4500 7.5056 7.5478 7.5768 7.7864 7.8652 7.9733 8.1018 8.2088 8.3730 8.4451 8.4868 8.5452 8.6570 8.6821 8.8264 8.9637 9.0615 9.1233 9.3075 9.3762 9.4921 9.5040 9.5815 9.7963 9.9744 10.0403 10.1192 10.3412 10.3942 10.4977 10.6725 10.7343 10.8551 10.9963 11.0741 11.2577 11.3989 11.4183 11.5278 11.6058 11.7006 11.7540 11.8685 11.9605 12.1352 12.2642 12.3562 12.3953 12.4505 12.6315 12.7377 12.9212 12.9674 13.0455 13.0825 13.1945 13.3139 13.3884 13.4382 13.5046 13.6969 13.7481 13.8122 13.8556 13.9451 14.0712 14.1257 14.1752 14.2916 14.3880 14.4298 14.4654 14.5498 14.6381 14.7054 14.7860 14.9565 15.0065 15.0646 15.1255 15.1536 15.2100 15.2872 15.2944 15.4393 15.4867 15.5370 15.6733 15.7225 15.8039 15.9733 16.0049 16.0621 16.2091 16.3067 16.4497 16.5087 16.5616 16.6732 16.7275 16.8169 16.9340 17.0168 17.0688 17.1840 17.3795 17.3997 17.5024 17.6273 17.7105 17.7962 17.8655 18.0915 18.2440 18.3451 18.5120 18.6218 18.6926 18.8494 18.9605 19.2424 19.2892 19.5215 19.6563 19.8525 19.8806 20.0672 20.1838 20.3232 20.5302 20.6763 20.7399 20.7783 21.0773 21.1275 21.2861 21.4643 21.5742 21.5927 21.9239 21.9760 22.0429 22.2617 22.4830 22.6506 22.7763 22.9940 23.0693 23.1302 23.3152 23.3951 23.5669 23.6440 23.7173 23.9493 24.0554 24.1790 24.2951 24.3783 24.5509 24.7767 24.8543 24.9524 25.0650 25.3097 25.3962 25.5628 25.8998 25.9575 26.0074 26.0432 26.2066 26.2992 26.3711 26.5019 26.6101 26.6329 26.9212 26.9582 27.0703 27.2054 27.3584 27.4039 27.6802 27.7673 27.8354 28.0726 28.1227 28.2238 28.4132 28.6152 28.7055 28.7731 28.9794 29.0351 29.1707 29.3235 29.4599 29.5228 29.5981 29.7473 29.8360 29.9078 30.1058 30.1821 30.2270 30.3907 30.5461 30.6570 30.7514 30.9730 31.0123 31.0417 31.2110 31.3299 31.4962 31.5293 31.6936 31.9371 32.0460 32.1364 32.2228 32.3383 32.4828 32.6095 32.6865 32.7754 32.8524 32.9390 33.1048 33.2651 33.3310 33.4838 33.7114 33.8415 33.8701 34.0400 34.1634 34.2271 34.3266 34.5512 34.6143 34.6665 34.8591 35.0346 35.0464 35.2450 35.4269 35.4846 35.5068 35.6523 35.8297 35.9127 36.0224 36.1647 36.2945 36.4452 36.6247 36.8127 36.8917 36.9824 37.1377 37.2136 37.3023 37.4780 37.6770 37.7614 37.9220 38.1920 38.3220 38.3916 38.4099 38.4686 38.5989 38.7615 38.9684 39.0198 39.1410 39.3712 39.3838 39.4356 39.5746 39.7061 39.8354 39.9107 40.1382 40.2852 40.4730 40.7087 40.7980 40.8619 40.9351 41.0849 41.2467 41.3296 41.4514 41.6240 41.6661 41.8441 41.9045 42.0176 42.0788 42.2386 42.2708 42.4153 42.4629 42.6009 42.6590 42.7934 42.8249 42.8505 42.9928 43.0102 43.2605 43.3412 43.5523 43.5848 43.7381 43.8667 43.9113 44.0832 44.1819 44.3795 44.4126 44.5296 44.6278 44.7246 44.8742 45.0048 45.1519 45.1883 45.2745 45.4405 45.5326 45.5724 45.6218 45.9154 45.9938 46.1312 46.2074 46.3698 46.4046 46.6245 46.7141 46.8433 46.9171 47.0409 47.2793 47.4876 47.6106 47.6953 47.7827 47.9127 47.9523 48.2278 48.3224 48.3997 48.6022 48.7003 48.8151 48.9341 49.0576 49.2011 49.2872 49.4316 49.6078 49.7987 49.9289 49.9908 50.5630 50.6102 50.7773 50.8618 51.1668 51.3869 51.3956 51.6545 51.8790 52.1205 52.1758 52.2722 52.7612 53.0141 53.1570 53.5555 53.6374 53.9148 53.9945 54.2335 54.2839 54.7586 54.8596 55.3406 55.5072 55.7996 56.1360 56.3772 56.5538 56.8132 57.2107 57.4103 57.5672 57.9801 58.1791 58.3238 58.4459 58.4591 58.6087 58.7309 58.8192 59.0769 59.4960 59.5124 59.6155 59.8795 59.9554 60.3497 60.5277 60.5471 60.8146 61.1985 61.2658 61.4687 61.5084 61.7010 62.1771 62.3027 62.4849 62.6124 62.8064 63.2198 63.5893 63.9653 63.9742 64.3266 64.6035 64.7262 64.8731 65.0126 65.0849 65.1957 65.3989 65.7466 66.1883 66.3303 66.5693 67.0630 67.3835 67.5283 67.9985 68.2878 68.4414 68.8405 68.9137 69.1260 69.3025 69.5363 69.8186 69.9978 70.1802 70.3804 70.7131 70.8204 70.9100 71.0767 71.3885 71.4394 71.6503 71.8993 72.0955 72.4296 72.6552 72.7458 72.9292 73.0827 73.1857 73.2523 73.3429 73.5950 73.7632 74.0111 74.1281 74.1710 74.2206 74.3358 74.5825 74.8123 74.9303 75.1054 75.3670 75.6662 75.7756 75.8452 76.1714 76.3709 76.4976 76.6130 76.8124 76.9722 77.0490 77.3358 77.4026 77.5766 77.7518 78.0356 78.3110 78.3834 78.6714 78.7089 78.8625 78.9967 79.0376 79.2115 79.2968 79.5437 79.6220 79.7654 79.8242 79.9610 80.1418 80.2433 80.3631 80.4790 80.4901 80.5838 80.8581 80.9541 81.2137 81.4153 81.5231 81.6620 81.7043 81.7332 81.8928 81.9732 82.0515 82.2021 82.3309 82.5578 82.6472 82.6847 82.8707 82.9911 83.0022 83.2352 83.3790 83.4752 83.6040 83.8979 84.0161 84.1268 84.3120 84.4720 84.6205 84.6503 84.9457 85.1141 85.2181 85.3669 85.4785 85.4906 85.5694 85.6452 85.9342 86.1791 86.2214 86.2775 86.3631 86.4592 86.6102 86.6821 86.8574 86.9844 87.1914 87.3158 87.3579 87.5788 87.6575 87.6607 87.7999 87.9214 87.9915 88.2059 88.2864 88.4080 88.5508 88.6806 88.7615 88.9050 88.9668 89.0225 89.1963 89.2326 89.3977 89.6709 89.7635 89.8076 89.8425 90.0186 90.0507 90.1234 90.1377 90.2048 90.3589 90.5157 90.5454 90.7151 90.8976 90.9590 91.0832 91.2465 91.3410 91.5229 91.6518 91.9078 91.9573 92.0154 92.2084 92.2366 92.3737 92.5005 92.5937 92.6815 92.7741 92.9835 93.0483 93.1228 93.2573 93.4027 93.4444 93.5836 93.6563 93.8840 93.9282 93.9674 94.1035 94.3634 94.4419 94.5062 94.6713 94.7704 94.8891 95.0172 95.2894 95.3577 95.4294 95.6288 95.6773 95.8284 96.0880 96.2738 96.4418 96.6000 96.6377 96.7387 96.8716 96.9876 97.0989 97.3565 97.4809 97.7078 97.7875 97.8569 97.9976 98.1299 98.2667 98.3291 98.4080 98.5017 98.8558 98.9697 99.0566 99.4258 99.4574 99.5954 99.6465 99.7662 99.8845 99.9537 100.1823 100.4659 100.5888 100.7201 100.9056 101.0943 101.1453 101.2206 101.2439 101.4993 101.6883 102.0309 102.0500 102.2769 102.4198 102.5108 102.5672 102.7266 102.7845 102.8720 103.0670 103.2575 103.4294 103.5592 103.7511 103.7601 103.8796 104.1008 104.1878 104.4239 104.6195 104.6564 104.9422 105.0705 105.2469 105.3899 105.5098 105.6093 105.7290 105.9643 106.0260 106.1861 106.3145 106.4046 106.6338 106.8310 107.0638 107.1256 107.3353 107.7016 107.8524 107.8878 108.0301 108.3245 108.4597 108.5060 108.6263 108.7252 108.9408 109.0869 109.1067 109.2120 109.3049 109.4909 109.5853 109.7397 109.8805 110.2062 110.2915 110.3503 110.6304 110.7532 110.9103 110.9383 111.0359 111.2620 111.3007 111.3596 111.3676 111.5220 111.6610 111.8427 111.9042 112.0772 112.2444 112.4623 112.5572 112.6583 112.7556 112.7968 112.8539 112.9836 113.0190 113.2369 113.6358 113.7841 113.9837 114.0461 114.1885 114.3053 114.4326 114.5783 114.7285 114.7655 114.8610 115.0903 115.1377 115.2105 115.2933 115.4338 115.5270 115.5982 115.7942 115.8323 115.9652 116.1148 116.3419 116.3777 116.4612 116.5583 116.6739 116.7472 116.8622 116.9326 117.0414 117.1502 117.2497 117.3238 117.4879 117.5798 117.7225 117.8703 118.1291 118.1375 118.2078 118.3061 118.5988 118.7730 118.8923 118.9634 119.2239 119.2306 119.4040 119.4995 119.6103 119.6973 119.7479 120.0563 120.2482 120.2985 120.3595 120.5607 120.8153 121.0506 121.1162 121.2206 121.3658 121.4691 121.6426 122.1696 122.2764 122.2865 122.7277 122.9609 123.0935 123.1423 123.3853 123.4781 123.8374 123.9224 124.0826 124.3199 124.4191 124.6940 124.7845 125.0349 125.1958 125.5227 125.6366 125.8144 125.8938 125.9753 126.1819 126.4548 126.9867 127.1343 127.5575 127.6341 128.0203 128.3321 128.5703 128.9019 128.9464 129.0970 129.1778 129.4366 129.5532 129.8345 129.9336 130.0554 130.1501 130.2468 130.3977 130.5627 130.7262 130.7911 130.9196 131.0622 131.1226 131.4520 131.5852 131.7229 131.9640 132.0784 132.1287 132.2354 132.4150 132.5442 132.6448 132.9516 133.2105 133.4006 133.5759 133.7441 133.8627 134.0317 134.2429 134.3732 134.5827 134.9375 135.1267 135.4214 135.6152 135.8293 136.3230 136.4394 136.6458 136.8745 137.0359 137.3257 137.3674 137.5034 137.6458 137.8813 138.2856 138.3279 138.5373 138.6385 138.8377 139.3229 139.4017 139.4686 139.5891 139.8990 140.0288 140.6424 140.7375 140.8996 141.2019 141.3652 141.5228 141.8400 142.0558 142.1482 142.4679 142.6745 142.7960 142.9393 143.0943 143.2819 143.9881 144.2630 144.3887 144.5219 144.7058 144.8714 145.1700 145.5248 145.6489 145.8423 146.0980 146.2568 146.3369 146.3792 146.5009 146.5734 146.6984 146.8676 147.1003 147.1987 147.6601 147.9157 148.0623 148.1068 148.5457 148.6189 148.8218 148.8915 148.9733 149.2546 149.3758 149.4483 149.5457 149.7595 149.9066 150.0907 150.1521 150.3316 150.3695 150.4328 150.5045 150.9591 151.2095 151.3930 151.5866 151.7110 151.8382 152.0694 152.1778 152.3574 152.4727 152.7221 152.8871 153.3157 153.4019 153.5073 153.6508 153.8349 154.2228 154.3004 154.4493 154.7879 154.9273 155.1120 155.1795 155.3957 155.4900 155.6260 155.8252 155.9099 156.0562 156.2268 156.3270 156.6349 156.7050 157.0213 157.0765 157.3155 157.8642 158.0237 158.1374 158.3117 158.6155 158.7028 158.7513 159.2336 159.3125 159.5956 159.7497 160.0049 160.2477 160.3154 160.6067 160.8941 161.2672 161.8395 162.3213 162.4657 163.4581 163.6575 164.0184 164.1581 164.4260 164.7012 165.2759 166.3050 167.9260 168.4073 169.2219 170.2162 172.5489 173.1596 176.4574 177.3096 177.9742 178.5687 181.0989 182.2275 185.9292 186.9561 187.9528 188.8740 189.2865 189.7076 190.3342 192.6502 193.6575 193.7737 194.2153 195.5990 196.0403 196.8648 198.3034 203.9675 204.7882 206.8413 207.8994 208.6325 251.1008 255.8781 263.9747 553.9881 617.9638 624.6822 633.2142 633.5497 634.8257 638.9095 639.1738 639.4253 640.3350 642.0754 643.2956 643.5133 643.7964 645.7250 646.0686 646.7500 647.3557 647.6714 651.1732 657.3957 894.3661 898.4258 1199.7346 1212.1484 1217.1466 -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 53 54 55 56 57 S O O O 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 H H H H H H H H H 0.020964 -0.361176 -0.321596 -0.482481 -0.136230 -0.141601 0.355877 -0.123658 -0.107548 0.318064 -0.317139 -0.322560 -0.181864 0.063841 -0.156364 -0.200612 -0.116971 -0.108380 -0.101627 -0.119243 -0.054101 -0.082066 0.463981 -0.323472 -0.285122 -0.186991 0.091925 0.098899 0.095471 0.113929 0.101886 0.103514 0.098877 0.111350 0.148244 0.154869 0.146721 0.097384 0.096355 0.086856 0.104243 0.079614 0.069165 0.079319 0.070233 0.066818 0.015417 0.053285 0.060722 0.086035 0.097644 0.096267 0.090160 0.078818 0.078890 0.108241 0.100954 0.125969 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 S O O O 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 H H H H H H H H H 15.9790 8.3612 8.3216 8.4825 7.1362 7.1416 5.6441 6.1237 6.1075 5.6819 6.3171 6.3226 6.1819 5.9362 6.1564 6.2006 6.1170 6.1084 6.1016 6.1192 6.0541 6.0821 5.5360 6.3235 6.2851 6.1870 0.9081 0.9011 0.9045 0.8861 0.8981 0.8965 0.9011 0.8887 0.8518 0.8451 0.8533 0.9026 0.9036 0.9131 0.8958 0.9204 0.9308 0.9207 0.9298 0.9332 0.9846 0.9467 0.9393 0.9140 0.9024 0.9037 0.9098 0.9212 0.9211 0.8918 0.8990 0.8740 16.0000 8.0000 8.0000 8.0000 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 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 0.0210 -0.3612 -0.3216 -0.4825 -0.1362 -0.1416 0.3559 -0.1237 -0.1075 0.3181 -0.3171 -0.3226 -0.1819 0.0638 -0.1564 -0.2006 -0.1170 -0.1084 -0.1016 -0.1192 -0.0541 -0.0821 0.4640 -0.3235 -0.2851 -0.1870 0.0919 0.0989 0.0955 0.1139 0.1019 0.1035 0.0989 0.1113 0.1482 0.1549 0.1467 0.0974 0.0964 0.0869 0.1042 0.0796 0.0692 0.0793 0.0702 0.0668 0.0154 0.0533 0.0607 0.0860 0.0976 0.0963 0.0902 0.0788 0.0789 0.1082 0.1010 0.1260 2.3770 2.0771 2.0783 2.0289 3.0086 3.1605 3.7167 4.0113 3.6958 3.8787 3.9470 3.9888 3.9530 3.7816 3.8792 4.0033 3.9328 3.9545 3.8075 3.8702 3.8393 3.8571 4.2812 3.9559 3.9593 3.8927 1.0070 1.0039 1.0039 1.0052 1.0040 1.0053 1.0022 0.9989 0.9976 0.9897 0.9997 0.9931 1.0110 0.9978 1.0095 1.0141 1.0019 1.0135 1.0031 1.0074 1.0218 1.0114 1.0091 0.9946 1.0042 1.0006 1.0031 1.0005 1.0007 0.9883 1.0119 0.9968 2.3770 2.0771 2.0783 2.0289 3.0086 3.1605 3.7167 4.0113 3.6958 3.8787 3.9470 3.9888 3.9530 3.7816 3.8792 4.0033 3.9328 3.9545 3.8075 3.8702 3.8393 3.8571 4.2812 3.9559 3.9593 3.8927 1.0070 1.0039 1.0039 1.0052 1.0040 1.0053 1.0022 0.9989 0.9976 0.9897 0.9997 0.9931 1.0110 0.9978 1.0095 1.0141 1.0019 1.0135 1.0031 1.0074 1.0218 1.0114 1.0091 0.9946 1.0042 1.0006 1.0031 1.0005 1.0007 0.9883 1.0119 0.9968 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 1.1848 0.9680 0.7984 1.1240 0.8694 1.1060 1.8685 0.9150 0.8990 1.2531 0.8988 0.9511 0.9404 0.9585 0.9572 0.9912 1.0059 1.3315 1.3824 1.3224 0.9915 0.9852 0.9919 0.9895 0.9906 0.9783 1.4328 0.9809 1.4458 1.4165 0.9899 0.9768 0.9165 1.0028 1.0063 0.9560 0.9976 0.9928 0.9380 0.9954 1.0001 0.9270 0.9965 1.0022 0.9224 1.0046 0.9944 0.9385 1.0001 1.0014 0.9987 0.9988 1.0055 1.0013 0.9969 0.9974 0.9827 0.9811 0.9788 0 4 0 5 1 6 1 9 2 13 2 22 3 22 4 16 4 17 5 22 5 25 6 7 6 10 6 11 7 8 7 26 7 27 8 9 8 12 9 13 10 28 10 29 10 30 11 31 11 32 11 33 12 14 12 34 13 15 14 15 14 35 15 36 16 18 16 37 16 38 17 19 17 39 17 40 18 20 18 41 18 42 19 21 19 43 19 44 20 23 20 45 20 46 21 24 21 47 21 48 23 49 23 50 23 51 24 52 24 53 24 54 25 55 25 56 25 57 -0.034813502 -1514.959452098061 -18.22812 17.95230 -0.27582 -7.10332 6.29113 -0.81219 -27.76054 25.84816 -1.91237 2.09592 5.32742