Orca 5.0.2 RELEASE 1 2 3 4 5 6 14s9p3d1f 11s6p2d1f 11s6p2d1f 11s6p2d1f 11s6p2d1f 5s2p1d 5s5p3d1f 5s3p2d1f 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 Cl F F F F O O O O O O N N N C 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 1 2 2 2 2 3 3 3 3 3 3 4 4 4 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 501.68781279999973 AuxInfo=1/0/N:35,22,34,30,29,32,25,20,19,31,26,21,15,27,23,16,18,33,28,17,24,1,2,3,4,5,14,13,12,8,11,7,10,9,6/E:(24,25,26)/CRV:4.3,5.3,6.3,7.3,8.3,9.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,18.3,19.3,20.3,27.2,30.1,31.1,32.1/rA:51nClFFFFOO1O1OOO1NNN2C3C3C3C3C3C3C3CC3CC3C3C3C3C3C3CC3C3CCHHHHHHHHHHHHHHHH/rB:;;;;;;;;;;;;;s12;s13;s7s12s13;s8s12;s16s18;s15;s2s15;s13;s6s20;s3s4s5s16;s21;s1s23s25;s6;s9s14s27;s27;s29;s9;s14s30;s10s11s31;s10;s34;s19;s20;s22;s22;s22;s25;s29;s30;s31;s31;s32;s34;s34;s35;s35;s35;/rC:5.0093,-2.2255,-.4415;.215,-3.6333,-1.0478;-5.6249,-1.7378,.5115;-5.2165,.1187,1.5392;-5.3722,.0791,-.5971;3.7839,.0431,.8168;-.8203,-2.2353,2.2262;-.7769,-.5043,-1.965;2.4113,1.5963,-1.0037;-.6373,3.1051,-2.039;-.181,1.9961,-.139;-.796,-1.3717,.1374;-2.7954,-1.482,1.3826;2.5452,3.4262,.3709;.6038,-1.6063,.0597;-3.4428,-.8731,.3363;-1.4251,-1.7341,1.3161;-1.4008,-.7756,-.9688;-2.816,-.5288,-.7963;1.491,-.674,.5603;1.0806,-2.7399,-.5678;-3.4486,-1.8395,2.6413;2.853,-.8457,.3905;-4.9277,-.6009,.4537;2.4349,-2.952,-.7123;3.3192,-1.9962,-.2397;3.4568,1.3393,1.0727;2.7908,2.1613,.1455;3.8644,1.9084,2.2582;3.6121,3.2571,2.49;1.5237,2.3022,-1.8262;2.9461,3.9696,1.5155;.1474,2.4373,-1.2038;-2.0402,3.1997,-1.773;-2.801,2.64,-2.9541;-3.3359,-.0663,-1.6183;1.0977,.2039,1.053;-2.7978,-2.5211,3.1748;-3.6108,-.9633,3.2659;-4.3914,-2.3457,2.4638;2.7996,-3.8427,-1.2039;4.3826,1.2993,2.9874;3.9224,3.7318,3.4095;1.9031,3.2914,-2.0944;1.4313,1.71,-2.7376;2.7236,5.0214,1.648;-2.2691,4.256,-1.6216;-2.2891,2.6685,-.8545;-2.5906,3.1941,-3.8682;-2.5407,1.5955,-3.1252;-3.8733,2.7021,-2.7659; 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 1893 RIJ-COSX (HFX calculated with COS-X)) on IntName inp HFTyp RHF Charge 0 Mult 1 NEL 264 Dim 1320 ENuc 4262.3758414827 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 6.667e-06 Time for diagonalization 0.606 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.300 sec Total time needed 0.913 sec 17 9 9 9 9 8 8 8 8 8 8 7 7 7 6 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 1 501.68781279999973 AuxInfo=1/0/N:35,22,34,30,29,32,25,20,19,31,26,21,15,27,23,16,18,33,28,17,24,1,2,3,4,5,14,13,12,8,11,7,10,9,6/E:(24,25,26)/CRV:4.3,5.3,6.3,7.3,8.3,9.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,18.3,19.3,20.3,27.2,30.1,31.1,32.1/rA:51nClFFFFOO1O1OOO1NNN2C3C3C3C3C3C3C3CC3CC3C3C3C3C3C3CC3C3CCHHHHHHHHHHHHHHHH/rB:;;;;;;;;;;;;;s12;s13;s7s12s13;s8s12;s16s18;s15;s2s15;s13;s6s20;s3s4s5s16;s21;s1s23s25;s6;s9s14s27;s27;s29;s9;s14s30;s10s11s31;s10;s34;s19;s20;s22;s22;s22;s25;s29;s30;s31;s31;s32;s34;s34;s35;s35;s35;/rC:5.0093,-2.2255,-.4415;.215,-3.6333,-1.0478;-5.6249,-1.7378,.5115;-5.2165,.1187,1.5392;-5.3722,.0791,-.5971;3.7839,.0431,.8168;-.8203,-2.2353,2.2262;-.7769,-.5043,-1.965;2.4113,1.5963,-1.0037;-.6373,3.1051,-2.039;-.181,1.9961,-.139;-.796,-1.3717,.1374;-2.7954,-1.482,1.3826;2.5452,3.4262,.3709;.6038,-1.6063,.0597;-3.4428,-.8731,.3363;-1.4251,-1.7341,1.3161;-1.4008,-.7756,-.9688;-2.816,-.5288,-.7963;1.491,-.674,.5603;1.0806,-2.7399,-.5678;-3.4486,-1.8395,2.6413;2.853,-.8457,.3905;-4.9277,-.6009,.4537;2.4349,-2.952,-.7123;3.3192,-1.9962,-.2397;3.4568,1.3393,1.0727;2.7908,2.1613,.1455;3.8644,1.9084,2.2582;3.6121,3.2571,2.49;1.5237,2.3022,-1.8262;2.9461,3.9696,1.5155;.1474,2.4373,-1.2038;-2.0402,3.1997,-1.773;-2.801,2.64,-2.9541;-3.3359,-.0663,-1.6183;1.0977,.2039,1.053;-2.7978,-2.5211,3.1748;-3.6108,-.9633,3.2659;-4.3914,-2.3457,2.4638;2.7996,-3.8427,-1.2039;4.3826,1.2993,2.9873;3.9224,3.7318,3.4095;1.9031,3.2914,-2.0944;1.4313,1.71,-2.7375;2.7236,5.0214,1.648;-2.2691,4.256,-1.6216;-2.2891,2.6685,-.8545;-2.5906,3.1941,-3.8682;-2.5407,1.5955,-3.1252;-3.8733,2.7021,-2.7659; 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 4 501.68781279999973 AuxInfo=1/0/N:35,22,34,30,29,32,25,20,19,31,26,21,15,27,23,16,18,33,28,17,24,1,2,3,4,5,14,13,12,8,11,7,10,9,6/E:(24,25,26)/CRV:4.3,5.3,6.3,7.3,8.3,9.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,18.3,19.3,20.3,27.2,30.1,31.1,32.1/rA:51nClFFFFOO1O1OOO1NNN2C3C3C3C3C3C3C3CC3CC3C3C3C3C3C3CC3C3CCHHHHHHHHHHHHHHHH/rB:;;;;;;;;;;;;;s12;s13;s7s12s13;s8s12;s16s18;s15;s2s15;s13;s6s20;s3s4s5s16;s21;s1s23s25;s6;s9s14s27;s27;s29;s9;s14s30;s10s11s31;s10;s34;s19;s20;s22;s22;s22;s25;s29;s30;s31;s31;s32;s34;s34;s35;s35;s35;/rC:5.0093,-2.2255,-.4415;.215,-3.6333,-1.0478;-5.6249,-1.7378,.5115;-5.2165,.1187,1.5392;-5.3722,.0791,-.5971;3.7839,.0431,.8168;-.8203,-2.2353,2.2262;-.7769,-.5043,-1.965;2.4113,1.5963,-1.0037;-.6373,3.1051,-2.039;-.181,1.9961,-.139;-.796,-1.3717,.1374;-2.7954,-1.482,1.3826;2.5452,3.4262,.3709;.6038,-1.6063,.0597;-3.4428,-.8731,.3363;-1.4251,-1.7341,1.3161;-1.4008,-.7756,-.9688;-2.816,-.5288,-.7963;1.491,-.674,.5603;1.0806,-2.7399,-.5678;-3.4486,-1.8395,2.6413;2.853,-.8457,.3905;-4.9277,-.6009,.4537;2.4349,-2.952,-.7123;3.3192,-1.9962,-.2397;3.4568,1.3393,1.0727;2.7908,2.1613,.1455;3.8644,1.9084,2.2582;3.6121,3.2571,2.49;1.5237,2.3022,-1.8262;2.9461,3.9696,1.5155;.1474,2.4373,-1.2038;-2.0402,3.1997,-1.773;-2.801,2.64,-2.9541;-3.3359,-.0663,-1.6183;1.0977,.2039,1.053;-2.7978,-2.5211,3.1748;-3.6108,-.9633,3.2659;-4.3914,-2.3457,2.4638;2.7996,-3.8427,-1.2039;4.3826,1.2993,2.9874;3.9224,3.7318,3.4095;1.9031,3.2914,-2.0944;1.4313,1.71,-2.7376;2.7236,5.0214,1.648;-2.2691,4.256,-1.6216;-2.2891,2.6685,-.8545;-2.5906,3.1941,-3.8682;-2.5407,1.5955,-3.1252;-3.8733,2.7021,-2.7659; -2285.29274791 4262.37584148 -6547.66858940 -11623.85267672 5076.18408733 -4563.13996580 2277.84721788 2.00326867 131.999872884385 131.999872884385 263.999745768770 -184.626225912341 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 1265 1266 1267 1268 1269 1270 1271 1272 1273 1274 1275 1276 1277 1278 1279 1280 1281 1282 1283 1284 1285 1286 1287 1288 1289 1290 1291 1292 1293 1294 1295 1296 1297 1298 1299 1300 1301 1302 1303 1304 1305 1306 1307 1308 1309 1310 1311 1312 1313 1314 1315 1316 1317 1318 1319 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 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 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -2765.2523 -676.1906 -676.1845 -676.1686 -674.9957 -524.9101 -524.7889 -524.6604 -523.1573 -523.0891 -523.0439 -394.9631 -394.5305 -392.5491 -287.5593 -284.1401 -283.4350 -283.2939 -282.7131 -282.4914 -282.2908 -281.9047 -281.7770 -281.6710 -281.5916 -281.4121 -281.2753 -281.1242 -280.7960 -280.6448 -280.3883 -280.2822 -280.2014 -279.9821 -279.6893 -260.5203 -199.3624 -199.1198 -199.1056 -40.0999 -37.5338 -37.5130 -36.9296 -33.8245 -33.5121 -33.2748 -32.9896 -32.2548 -31.2417 -30.5740 -29.6348 -29.2409 -27.8403 -26.4039 -26.1292 -25.5444 -25.0254 -24.4739 -24.3579 -23.9657 -23.3903 -23.2533 -22.9367 -21.9271 -21.3495 -21.2906 -21.1906 -20.3632 -20.1797 -20.1553 -20.0606 -19.9099 -19.5627 -18.9892 -18.6818 -18.3762 -18.1095 -17.8578 -17.8155 -17.3056 -17.2051 -17.0947 -16.9727 -16.5923 -16.5670 -16.4513 -16.1118 -16.0119 -15.9934 -15.8356 -15.7188 -15.6230 -15.5120 -15.4138 -15.1999 -15.1149 -15.0434 -14.9441 -14.8539 -14.8361 -14.7801 -14.6671 -14.4859 -14.4246 -14.2873 -14.1343 -13.9649 -13.8728 -13.7854 -13.7367 -13.5580 -13.4253 -12.9516 -12.8194 -12.7491 -12.6163 -12.4993 -12.1403 -12.1092 -11.7766 -11.2052 -11.1611 -11.0810 -10.7015 -10.6147 -10.3615 -10.2992 -10.2167 -9.5620 -9.4177 -8.9730 -8.4322 0.1005 1.0563 1.1951 1.7046 1.9709 2.0754 2.4427 3.0056 3.0608 3.3373 3.6517 3.8934 3.9816 4.1431 4.2595 4.3818 4.5199 4.6234 4.6792 4.7686 4.8231 4.9668 5.0680 5.1814 5.2683 5.3019 5.3970 5.5574 5.6380 5.7259 5.7843 6.0287 6.1109 6.1741 6.2831 6.3483 6.5121 6.5585 6.6037 6.8240 6.9083 7.0340 7.0974 7.2430 7.3720 7.4776 7.6336 7.6636 7.8135 7.9830 8.0764 8.1318 8.2066 8.2704 8.3646 8.5404 8.6031 8.6920 8.7280 8.7754 8.9078 8.9259 9.0759 9.2147 9.2721 9.3213 9.4273 9.5921 9.6768 9.7470 9.8621 9.8632 9.9360 10.2455 10.3533 10.4128 10.5446 10.6718 10.6778 10.9041 10.9450 11.0166 11.1009 11.2712 11.3908 11.5296 11.6038 11.6788 11.7134 11.7518 11.8821 11.9931 12.1395 12.1592 12.2567 12.2981 12.3681 12.4111 12.6369 12.6706 12.7006 12.8213 12.8942 12.9354 12.9897 13.1156 13.2285 13.2823 13.3444 13.4806 13.4941 13.6578 13.7159 13.7793 13.7867 13.8963 13.9860 14.0601 14.1203 14.1891 14.2821 14.4370 14.5263 14.6015 14.7503 14.7698 14.9289 14.9735 15.0410 15.1993 15.2738 15.4967 15.5474 15.6105 15.6898 15.8414 15.9715 16.0946 16.2355 16.2524 16.3166 16.3928 16.4629 16.5042 16.7381 16.8371 17.0486 17.0708 17.2310 17.4041 17.4710 17.5417 17.6029 17.8024 17.8292 18.0423 18.2347 18.3260 18.4382 18.5815 18.6791 18.7931 18.8909 18.9162 19.0773 19.0882 19.2489 19.2973 19.4512 19.4735 19.6258 19.8171 19.9577 20.0542 20.2060 20.2579 20.4168 20.4692 20.8164 20.8302 20.9664 21.0937 21.2175 21.4414 21.5325 21.6088 21.6974 21.7772 21.8491 21.9640 22.0665 22.0902 22.1550 22.2932 22.3995 22.5466 22.5674 22.7400 22.8098 22.9632 23.0607 23.2201 23.2250 23.3585 23.6182 23.6693 23.8554 23.9096 24.0147 24.0490 24.2075 24.3120 24.5370 24.7125 24.7793 24.9484 25.0327 25.1073 25.2542 25.2908 25.3833 25.4528 25.6325 25.7320 25.8440 25.8872 26.0907 26.1260 26.2694 26.4123 26.5356 26.6871 26.7086 26.8016 27.0182 27.0837 27.3944 27.5017 27.5783 27.6795 27.7982 27.8892 27.9419 28.1153 28.2558 28.3260 28.4872 28.6457 28.7138 28.7543 29.0562 29.1052 29.1679 29.3012 29.4064 29.5910 29.7667 29.8061 29.9418 30.0065 30.2010 30.2533 30.4490 30.5802 30.6793 30.7552 30.9248 31.0964 31.1649 31.3164 31.4583 31.6537 31.8341 31.8841 32.0783 32.1847 32.3570 32.3731 32.4670 32.7068 32.7832 32.9247 32.9777 33.0334 33.2951 33.3750 33.4501 33.5533 33.6499 33.7971 34.0576 34.0991 34.2175 34.3517 34.6383 34.6587 34.8774 35.1177 35.1881 35.3573 35.3967 35.6506 35.7366 35.9017 35.9769 36.1598 36.3351 36.4399 36.6807 36.7941 36.9187 37.1178 37.3164 37.4509 37.5529 37.6170 37.8103 37.9561 38.0092 38.3536 38.3812 38.5779 38.7185 38.8341 38.8826 38.9442 39.0944 39.4006 39.4686 39.6385 39.7682 39.8090 40.0761 40.2426 40.2737 40.3328 40.7322 40.8126 40.9158 41.1086 41.2731 41.4510 41.4997 41.8522 41.9224 42.0087 42.2757 42.3354 42.5445 42.5595 42.6632 42.7407 42.9011 43.0045 43.0658 43.1865 43.2848 43.4474 43.5573 43.7079 43.7994 44.1206 44.1302 44.2431 44.3251 44.3913 44.6011 44.6928 44.7952 45.0739 45.1563 45.2974 45.4003 45.4962 45.6847 45.7355 45.9913 46.1104 46.1729 46.3092 46.4576 46.5925 46.8353 46.9388 47.3133 47.3948 47.5232 47.6019 47.9941 48.0219 48.2897 48.3833 48.4586 48.7193 48.8364 49.2067 49.4030 49.5013 49.7106 49.7144 49.9002 49.9948 50.1791 50.2690 50.3206 50.6955 50.8594 50.9850 51.0662 51.4670 51.5321 51.5827 51.7495 51.7859 51.9592 52.2173 52.2962 52.3342 52.6331 52.7626 52.8264 53.0868 53.2286 53.3729 53.4553 53.8198 53.9979 54.0637 54.1002 54.3019 54.3769 54.5088 54.8007 54.9896 55.2113 55.3631 55.5437 55.5897 55.8496 56.1299 56.2422 56.4655 56.8133 56.8592 57.2104 57.3275 57.4335 57.5552 57.6279 57.8277 58.1535 58.4311 58.5883 58.7320 58.7899 58.9277 59.1928 59.2560 59.3636 59.6288 59.7458 59.8349 59.9498 59.9907 60.1862 60.3656 60.6165 60.6452 61.1853 61.3333 61.4236 61.6681 61.7553 61.7738 62.0533 62.1946 62.3045 62.7309 62.8415 63.1027 63.1535 63.3186 63.4526 63.5281 63.6571 63.9129 64.0670 64.2104 64.4040 64.6740 64.7097 64.9631 65.0546 65.1070 65.3402 65.3645 65.6452 65.9431 66.0191 66.1907 66.3510 66.5130 66.6316 66.7471 66.9374 67.0726 67.2216 67.2880 67.6174 67.7230 67.9582 68.1452 68.5674 68.6583 68.8590 69.1217 69.3029 69.6897 69.8501 70.0066 70.1486 70.3201 70.6417 70.9946 71.1071 71.3307 71.4789 71.5649 71.7914 72.0024 72.0104 72.2754 72.4472 72.5096 72.6603 72.7962 72.9420 73.1307 73.4866 73.5310 73.6377 73.9964 74.3304 74.5387 74.7680 75.0437 75.0715 75.4508 75.5951 75.7418 75.9223 76.1653 76.3081 76.5175 76.7466 76.7832 76.9033 77.0856 77.3916 77.5646 77.6616 77.8443 77.9150 78.1859 78.3439 78.5851 78.6897 78.8111 78.9404 79.0608 79.2702 79.4309 79.5404 79.6059 79.6418 79.8175 79.9355 80.0595 80.1614 80.2502 80.3844 80.5432 80.6430 80.7114 80.7645 81.0381 81.1231 81.1681 81.2755 81.3698 81.5354 81.7321 81.8137 81.9352 82.1037 82.1711 82.3710 82.4470 82.6465 82.7370 82.7963 82.9131 83.1428 83.2012 83.3680 83.4994 83.6285 83.7433 83.8499 83.9495 84.0560 84.1617 84.3982 84.4156 84.4255 84.6836 84.7502 84.9021 85.0759 85.1725 85.3348 85.4375 85.5456 85.8047 85.9438 86.0460 86.1920 86.2548 86.4018 86.4506 86.5139 86.7702 86.8312 86.8892 86.9644 87.1247 87.2260 87.3766 87.4374 87.4943 87.6405 87.7870 87.9028 88.0550 88.2318 88.3940 88.4908 88.5557 88.7326 88.7577 88.8723 88.9570 89.1061 89.1961 89.2716 89.4071 89.4672 89.5531 89.7029 89.8382 89.9563 90.0200 90.2786 90.4839 90.5288 90.7433 90.7873 90.8603 91.0411 91.2366 91.3281 91.4377 91.5988 91.7143 91.7490 91.9470 92.0952 92.3205 92.4493 92.5277 92.5904 92.8324 92.9102 93.0072 93.0599 93.1056 93.1764 93.3334 93.4666 93.7159 93.7981 93.8924 94.0051 94.0296 94.2173 94.2634 94.4599 94.6044 94.7031 94.7569 95.0011 95.0873 95.1519 95.2528 95.3871 95.4957 95.5604 95.7765 95.9167 96.0644 96.1532 96.2754 96.3756 96.4241 96.6932 96.9270 97.0226 97.1287 97.2120 97.3938 97.4730 97.5438 97.7032 97.8046 97.9910 98.0965 98.1226 98.3326 98.5052 98.7653 98.8548 98.9065 99.0713 99.3150 99.4713 99.6846 99.7909 99.9330 100.0705 100.2661 100.3449 100.5983 100.8244 100.9113 101.0208 101.2018 101.4051 101.4504 101.7479 101.8344 101.9716 102.1968 102.4831 102.5247 102.8434 102.9205 103.0804 103.2552 103.5102 103.6684 103.7673 103.8070 103.9788 104.1385 104.2943 104.4172 104.7544 104.8638 105.0340 105.0782 105.2418 105.2835 105.3603 105.6784 105.8426 105.8724 106.0816 106.1932 106.4354 106.5997 106.8488 106.9114 107.0491 107.3570 107.4658 107.5237 107.8580 107.9000 107.9533 108.0916 108.2732 108.5231 108.6888 108.8058 108.8675 108.9931 109.1917 109.3978 109.6107 109.7349 109.8907 109.9480 110.2234 110.3450 110.5002 110.6434 110.7079 110.9812 111.2112 111.4675 111.6416 111.8372 111.9543 112.1074 112.4161 112.5367 112.7362 112.9264 113.0540 113.1874 113.3123 113.4729 113.6337 113.9278 113.9862 114.1866 114.3381 114.5036 114.6455 114.7671 114.9328 115.0215 115.1758 115.2520 115.3262 115.5999 115.8013 115.9544 116.1183 116.1708 116.2399 116.5786 116.7668 116.8623 116.9256 117.1062 117.5500 117.7927 117.8204 117.9935 118.1146 118.1635 118.2935 118.6570 118.7486 118.9294 119.1151 119.2759 119.3493 119.6842 119.7801 119.8413 120.1663 120.2181 120.4414 120.5585 120.6940 120.7999 121.2374 121.4532 121.4997 121.7747 121.9458 122.0608 122.2909 122.6175 122.8592 123.1178 123.2364 123.5979 123.7776 123.9660 124.2076 124.3210 124.6495 124.8506 125.1290 125.3283 125.8077 125.9054 126.1693 126.4109 126.4775 126.7426 127.0773 127.3849 127.6282 127.8356 128.1293 128.3208 128.6405 128.9626 129.2453 129.3941 129.5613 129.9708 130.1819 130.5388 130.7459 131.4888 131.7311 132.2132 132.5351 132.7214 133.0158 133.0703 133.5289 133.7033 133.8470 134.0239 134.4693 134.5458 134.7051 134.7995 135.1669 135.4053 135.4796 135.7577 135.9025 135.9763 136.0104 136.3521 136.5569 136.7590 137.1947 137.5222 137.7415 137.8272 138.0114 138.4105 138.6313 138.7645 138.9902 139.0929 139.1597 139.7801 140.0511 140.2544 140.6587 140.9335 141.4592 141.5772 142.0725 142.1826 142.5906 142.8232 142.9884 143.3269 143.4059 143.5130 143.7295 143.8424 144.0466 144.3240 144.4675 144.8330 145.0277 145.2141 145.4573 145.4764 146.0672 146.1437 146.1576 146.5256 146.6457 146.9952 147.2842 148.0042 148.0569 148.2078 148.3232 148.3622 148.4416 148.6113 148.7417 149.1187 149.2013 149.6458 149.6697 149.7270 150.3675 150.4263 150.5390 150.6137 150.7791 151.0097 151.0556 151.3781 151.4091 151.6586 151.7516 151.9554 152.2949 152.3586 152.5739 152.8337 153.1803 153.4011 153.6258 153.8668 154.1026 154.5114 154.7895 155.0287 155.3488 155.7052 156.1184 156.3998 156.5052 156.8267 156.9045 157.4323 157.7583 157.9665 158.4728 158.5785 159.1171 159.4665 159.9686 160.4225 160.6285 161.1029 161.7859 161.8426 162.0564 162.8667 163.7290 165.4775 165.7076 165.8456 166.3649 167.0591 167.3539 167.6227 168.7177 169.6088 169.7712 170.3044 171.2810 171.8595 172.9501 173.2197 174.1264 174.6108 174.9190 176.3772 177.5777 177.8655 178.3261 178.5581 178.9314 179.5982 179.9785 180.9704 181.2897 182.8866 183.6450 183.9588 184.9927 185.7599 185.9983 186.2281 186.7413 187.5841 187.8537 187.9010 188.1513 188.2738 188.3457 188.4207 188.5675 188.7021 188.8591 188.9751 189.0131 189.5291 189.6690 189.8172 190.1499 190.8509 191.6248 191.7711 191.9530 192.6527 192.7084 192.9340 193.8964 194.0527 194.2317 194.8768 195.6112 195.8766 196.0720 196.2899 196.3616 196.6573 197.3218 198.8379 198.9648 200.1792 201.7271 202.0561 202.3974 202.7943 202.9030 203.9983 204.7404 206.2446 206.4856 206.5337 206.8724 208.6562 208.8031 209.7611 212.0403 221.9274 223.5376 223.9205 227.2333 228.1549 228.2989 228.5904 230.1749 230.2228 232.0541 233.0132 235.0042 236.2489 238.6904 240.5332 241.3007 241.4529 243.9747 245.6459 246.6331 247.1561 248.1782 249.1933 249.9635 250.9369 295.1224 298.2094 313.4514 615.9532 623.7701 625.1731 625.5439 626.8149 631.9359 632.5197 633.6253 635.2144 635.3081 637.8344 638.1741 638.2989 639.9967 642.8703 644.0887 646.2762 646.9144 648.1445 650.3395 651.2625 716.2554 892.0880 903.2416 907.0359 1200.9734 1201.3982 1203.1282 1209.0515 1212.3251 1217.2277 1558.4704 1560.1635 1564.8542 1565.3566 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 Cl F F F F O O O O O O N N N C 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 -0.051892 -0.202815 -0.157287 -0.158049 -0.155999 -0.298911 -0.371246 -0.373720 -0.272936 -0.273030 -0.391043 -0.067666 -0.127233 -0.344876 0.093377 -0.001131 0.353098 0.274388 -0.184558 -0.160700 0.205710 -0.209606 0.270373 0.534218 -0.138636 0.004991 0.118611 0.356517 -0.134869 -0.125288 0.013956 -0.005331 0.381231 0.020451 -0.250035 0.138492 0.130324 0.126037 0.126998 0.123562 0.111216 0.132031 0.124168 0.120526 0.131889 0.113641 0.098897 0.089514 0.095487 0.079097 0.088055 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 Cl F F F F O O O O O O N N N C 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 17.0519 9.2028 9.1573 9.1580 9.1560 8.2989 8.3712 8.3737 8.2729 8.2730 8.3910 7.0677 7.1272 7.3449 5.9066 6.0011 5.6469 5.7256 6.1846 6.1607 5.7943 6.2096 5.7296 5.4658 6.1386 5.9950 5.8814 5.6435 6.1349 6.1253 5.9860 6.0053 5.6188 5.9795 6.2500 0.8615 0.8697 0.8740 0.8730 0.8764 0.8888 0.8680 0.8758 0.8795 0.8681 0.8864 0.9011 0.9105 0.9045 0.9209 0.9119 17.0000 9.0000 9.0000 9.0000 9.0000 8.0000 8.0000 8.0000 8.0000 8.0000 8.0000 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 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 -0.0519 -0.2028 -0.1573 -0.1580 -0.1560 -0.2989 -0.3712 -0.3737 -0.2729 -0.2730 -0.3910 -0.0677 -0.1272 -0.3449 0.0934 -0.0011 0.3531 0.2744 -0.1846 -0.1607 0.2057 -0.2096 0.2704 0.5342 -0.1386 0.0050 0.1186 0.3565 -0.1349 -0.1253 0.0140 -0.0053 0.3812 0.0205 -0.2500 0.1385 0.1303 0.1260 0.1270 0.1236 0.1112 0.1320 0.1242 0.1205 0.1319 0.1136 0.0989 0.0895 0.0955 0.0791 0.0881 1.2629 1.0957 1.1527 1.1513 1.1522 2.1380 2.1441 2.1262 2.1357 2.1399 2.0876 3.1047 3.3220 3.0084 3.5144 4.0061 4.2672 4.2451 3.8150 4.0567 4.1925 3.8589 3.8978 4.4189 3.9980 3.9220 3.9156 3.9918 3.9917 3.8783 3.8622 4.0841 4.1147 3.8544 3.9231 1.0160 1.0345 1.0236 0.9900 1.0032 1.0255 1.0096 1.0021 1.0219 1.0055 1.0011 0.9961 1.0188 1.0094 1.0234 1.0074 1.2629 1.0957 1.1527 1.1513 1.1522 2.1380 2.1441 2.1262 2.1357 2.1399 2.0876 3.1047 3.3220 3.0084 3.5144 4.0061 4.2672 4.2451 3.8150 4.0567 4.1925 3.8589 3.8978 4.4189 3.9980 3.9220 3.9156 3.9918 3.9917 3.8783 3.8622 4.0841 4.1147 3.8544 3.9231 1.0160 1.0345 1.0236 0.9900 1.0032 1.0255 1.0096 1.0021 1.0219 1.0055 1.0011 0.9961 1.0188 1.0094 1.0234 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 1.1063 1.0510 1.1303 1.1264 1.1432 1.0510 0.9812 1.9804 1.9600 1.1284 0.9477 1.2061 0.8657 1.9121 0.7566 1.1380 1.1092 1.2139 1.1143 0.8965 1.3943 1.4728 1.4052 1.3989 1.6660 0.9985 1.0739 0.9797 1.4386 0.9174 1.4887 0.9707 0.9766 0.9749 1.3230 1.3695 0.9707 1.3095 1.4992 1.3701 0.9654 1.4604 0.9754 0.9272 0.9962 0.9600 0.9898 0.9592 0.9842 0.9958 0.9868 0.9874 0.9897 0 25 1 20 2 23 3 23 4 23 5 22 5 26 6 16 7 17 8 27 8 30 9 32 9 33 10 32 11 14 11 16 11 17 12 15 12 16 12 21 13 27 13 31 14 19 14 20 15 18 15 23 17 18 18 35 19 22 19 36 20 24 21 37 21 38 21 39 22 25 24 25 24 40 26 27 26 28 28 29 28 41 29 31 29 42 30 32 30 43 30 44 31 45 33 34 33 46 33 47 34 48 34 49 34 50 -0.032828816 -2285.325576729512 -0.78076 -0.48183 -1.26259 26.78638 -25.78579 1.00060 -1.75740 2.21534 0.45794 1.67482 4.25706