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 Si F O O C C C C 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 H H H H H H H H H H H H H 1 2 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 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 5 379.3502031999997 AuxInfo=1/0/N:23,8,9,22,29,27,28,6,10,25,26,18,14,15,11,12,20,5,17,13,16,24,7,21,19,2,3,4,1/E:(2,3)(6,7)(10,11)(13,14)(15,16)/CRV:5.3,6.3,7.3,10.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,19.3,20.3,21.3,22.3,23.3,24.3,25.3/rA:58nSiFOOCCC3CCCC3C3C3C3C3C3C3C3C3C3C3CCC3C3C3C3C3C3HHHHHHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;s1;s5;s1;s1;s1;s6;s7;s7;s10;s11;s12;s3s14s15;s13;s13;s4s17;s18;s2s19s20;s3;s22;s4;s24;s24;s25;s26;s27s28;s5;s5;s6;s6;s8;s8;s8;s9;s9;s9;s10;s10;s11;s12;s14;s15;s17;s18;s20;s22;s22;s23;s23;s23;s25;s26;s27;s28;s29;/rC:-3.6922,1.6752,.3894;1.8359,-4.8489,-.6299;2.244,2.7417,.9601;2.22,-2.225,-.3124;-4.0675,-.0311,1.1382;-2.9566,-1.0728,1.0185;-1.8526,2.0374,.5739;-4.6814,2.9569,1.35;-4.1721,1.7714,-1.4288;-2.637,-1.4621,-.4248;-1.3029,2.3309,1.8224;-.9627,1.9789,-.5041;-1.4559,-2.384,-.5103;.0552,2.561,2.0054;.3947,2.2027,-.3484;.9162,2.503,.9111;-.1706,-1.8588,-.4016;-1.6093,-3.7594,-.6493;.9403,-2.6848,-.4498;-.5042,-4.5991,-.6828;.7575,-4.0532,-.5904;2.8856,2.9731,2.21;3.1215,1.7015,2.9956;2.6231,-1.1161,-1.0156;2.1489,-.819,-2.2876;3.5861,-.3185,-.4133;2.6497,.2922,-2.9514;4.0854,.7818,-1.0948;3.6184,1.0954,-2.364;-4.2934,.1237,2.1985;-4.9939,-.4149,.6958;-3.2296,-1.9777,1.5703;-2.0481,-.6928,1.495;-4.5531,3.96,.9389;-5.7486,2.7255,1.3217;-4.3871,2.991,2.4011;-3.9977,2.7715,-1.8313;-3.626,1.0654,-2.0562;-5.2353,1.5534,-1.5522;-3.5132,-1.9325,-.8778;-2.4262,-.5661,-1.0142;-1.9415,2.3857,2.6977;-1.3289,1.7534,-1.4995;.4161,2.7854,3.0001;1.0598,2.1532,-1.203;-.0379,-.7883,-.2835;-2.6009,-4.1857,-.7338;-.6204,-5.6697,-.7922;2.3313,3.7089,2.7994;3.8402,3.4305,1.9507;2.1948,1.2079,3.2885;3.7212,.9928,2.4234;3.6693,1.9416,3.9075;1.4036,-1.4411,-2.7664;3.9459,-.5622,.5786;2.2801,.5242,-3.9418;4.8393,1.3989,-.6237;4.005,1.9573,-2.8909; 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 1742 RIJ-COSX (HFX calculated with COS-X)) on IntName inp HFTyp RHF Charge 0 Mult 1 NEL 218 Dim 1316 ENuc 2966.6705047371 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 5.074e-06 Time for diagonalization 0.389 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.453 sec Total time needed 0.851 sec 14 9 8 8 6 6 6 6 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 1 1 1 1 1 1 1 1 1 1 1 1 1 379.3502031999997 AuxInfo=1/0/N:23,8,9,22,29,27,28,6,10,25,26,18,14,15,11,12,20,5,17,13,16,24,7,21,19,2,3,4,1/E:(2,3)(6,7)(10,11)(13,14)(15,16)/CRV:5.3,6.3,7.3,10.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,19.3,20.3,21.3,22.3,23.3,24.3,25.3/rA:58nSiFOOCCC3CCCC3C3C3C3C3C3C3C3C3C3C3CCC3C3C3C3C3C3HHHHHHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;s1;s5;s1;s1;s1;s6;s7;s7;s10;s11;s12;s3s14s15;s13;s13;s4s17;s18;s2s19s20;s3;s22;s4;s24;s24;s25;s26;s27s28;s5;s5;s6;s6;s8;s8;s8;s9;s9;s9;s10;s10;s11;s12;s14;s15;s17;s18;s20;s22;s22;s23;s23;s23;s25;s26;s27;s28;s29;/rC:-3.6922,1.6752,.3894;1.8359,-4.8489,-.6299;2.244,2.7417,.9601;2.22,-2.225,-.3124;-4.0675,-.0311,1.1382;-2.9566,-1.0728,1.0185;-1.8526,2.0374,.5739;-4.6814,2.9569,1.35;-4.1721,1.7714,-1.4288;-2.637,-1.4621,-.4248;-1.3029,2.3309,1.8224;-.9627,1.9789,-.5041;-1.4559,-2.384,-.5103;.0552,2.561,2.0054;.3947,2.2027,-.3484;.9162,2.503,.9111;-.1706,-1.8588,-.4016;-1.6093,-3.7594,-.6493;.9403,-2.6848,-.4498;-.5042,-4.5991,-.6828;.7575,-4.0532,-.5904;2.8856,2.9731,2.21;3.1215,1.7015,2.9956;2.6231,-1.1161,-1.0156;2.1489,-.819,-2.2876;3.5861,-.3185,-.4133;2.6497,.2922,-2.9514;4.0854,.7818,-1.0948;3.6184,1.0954,-2.364;-4.2934,.1237,2.1985;-4.9939,-.4149,.6958;-3.2296,-1.9777,1.5703;-2.0481,-.6928,1.495;-4.5531,3.96,.9389;-5.7486,2.7255,1.3217;-4.3871,2.991,2.4011;-3.9977,2.7715,-1.8313;-3.626,1.0654,-2.0562;-5.2353,1.5534,-1.5522;-3.5132,-1.9325,-.8778;-2.4262,-.5661,-1.0142;-1.9415,2.3857,2.6977;-1.3289,1.7534,-1.4995;.4161,2.7854,3.0001;1.0598,2.1532,-1.203;-.0379,-.7883,-.2835;-2.6009,-4.1857,-.7338;-.6204,-5.6697,-.7922;2.3313,3.7089,2.7994;3.8402,3.4305,1.9507;2.1948,1.2079,3.2885;3.7212,.9928,2.4234;3.6693,1.9416,3.9075;1.4036,-1.4411,-2.7664;3.9459,-.5622,.5786;2.2801,.5242,-3.9418;4.8393,1.3989,-.6237;4.005,1.9573,-2.8909; 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" 379.3502031999997 AuxInfo=1/0/N:23,8,9,22,29,27,28,6,10,25,26,18,14,15,11,12,20,5,17,13,16,24,7,21,19,2,3,4,1/E:(2,3)(6,7)(10,11)(13,14)(15,16)/CRV:5.3,6.3,7.3,10.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,19.3,20.3,21.3,22.3,23.3,24.3,25.3/rA:58nSiFOOCCC3CCCC3C3C3C3C3C3C3C3C3C3C3CCC3C3C3C3C3C3HHHHHHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;s1;s5;s1;s1;s1;s6;s7;s7;s10;s11;s12;s3s14s15;s13;s13;s4s17;s18;s2s19s20;s3;s22;s4;s24;s24;s25;s26;s27s28;s5;s5;s6;s6;s8;s8;s8;s9;s9;s9;s10;s10;s11;s12;s14;s15;s17;s18;s20;s22;s22;s23;s23;s23;s25;s26;s27;s28;s29;/rC:-3.6922,1.6752,.3894;1.8359,-4.8489,-.6299;2.244,2.7417,.9601;2.22,-2.225,-.3124;-4.0675,-.0311,1.1382;-2.9566,-1.0728,1.0185;-1.8526,2.0374,.5739;-4.6814,2.9569,1.35;-4.1721,1.7714,-1.4288;-2.637,-1.4621,-.4248;-1.3029,2.3309,1.8224;-.9627,1.9789,-.5041;-1.4559,-2.384,-.5103;.0552,2.561,2.0054;.3947,2.2027,-.3484;.9162,2.503,.9111;-.1706,-1.8588,-.4016;-1.6093,-3.7594,-.6493;.9403,-2.6848,-.4498;-.5042,-4.5991,-.6828;.7575,-4.0532,-.5904;2.8856,2.9731,2.21;3.1215,1.7015,2.9956;2.6231,-1.1161,-1.0156;2.1489,-.819,-2.2876;3.5861,-.3185,-.4133;2.6497,.2922,-2.9514;4.0854,.7818,-1.0948;3.6184,1.0954,-2.364;-4.2934,.1237,2.1985;-4.9939,-.4149,.6958;-3.2296,-1.9777,1.5703;-2.0481,-.6928,1.495;-4.5531,3.96,.9389;-5.7486,2.7255,1.3217;-4.3871,2.991,2.4011;-3.9977,2.7715,-1.8313;-3.626,1.0654,-2.0562;-5.2353,1.5534,-1.5522;-3.5132,-1.9325,-.8778;-2.4262,-.5661,-1.0142;-1.9415,2.3857,2.6977;-1.3289,1.7534,-1.4995;.4161,2.7854,3.0001;1.0598,2.1532,-1.203;-.0379,-.7883,-.2835;-2.6009,-4.1857,-.7338;-.6204,-5.6697,-.7922;2.3313,3.7089,2.7994;3.8402,3.4305,1.9507;2.1948,1.2079,3.2885;3.7212,.9928,2.4234;3.6693,1.9416,3.9075;1.4036,-1.4411,-2.7664;3.9459,-.5622,.5786;2.2801,.5242,-3.9418;4.8393,1.3989,-.6237;4.005,1.9573,-2.8909; Epsilon 78.3550 Refrac 1.3328 Rsolv 1.3000 Surface type GAUSSIAN VDW Epsilon function type CPCM Si F O C H 2.4700 1.7300 1.5200 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 3388 GEPOL Volume 2923.5366 GEPOL Surface-area 1641.1434 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 0.8s) Overall time for CPCM initialization 0.9s -1510.05148969 2966.67050474 -4476.72199443 -7964.04607272 3487.32407829 -0.02855386 -3013.95920287 1503.90771318 2.00408521 109.000123184651 109.000123184651 218.000246369303 -135.233533057115 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 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 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 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -1800.5959 -674.9112 -524.7276 -524.1641 -281.9976 -281.6236 -281.5909 -281.4167 -280.8924 -279.9802 -279.8944 -279.8154 -279.7994 -279.7906 -279.7589 -279.7265 -279.7221 -279.7092 -279.7014 -279.6040 -279.5581 -279.4934 -279.3825 -279.3299 -279.1497 -279.1340 -278.8068 -278.6629 -278.6411 -145.6553 -100.7234 -100.7078 -100.6984 -36.7966 -32.9971 -32.3225 -27.0605 -26.6165 -26.4229 -24.9454 -24.1891 -24.1609 -23.6649 -23.5728 -23.4542 -23.0715 -22.8694 -22.0357 -21.4380 -21.2934 -20.6685 -20.4922 -19.8957 -19.5673 -19.4976 -19.0495 -18.6485 -18.5399 -18.0159 -17.5186 -17.3218 -16.8878 -16.3493 -16.1647 -16.1047 -16.0021 -15.6293 -15.2946 -15.1101 -14.9920 -14.8694 -14.7933 -14.6335 -14.4753 -14.3895 -14.2745 -14.2313 -13.9727 -13.8371 -13.7173 -13.6630 -13.5259 -13.3893 -13.2782 -13.1912 -12.9562 -12.9014 -12.8238 -12.7383 -12.5489 -12.4640 -12.4004 -12.1590 -11.9370 -11.8121 -11.7347 -11.4990 -11.4413 -11.3448 -11.1395 -10.4167 -10.3387 -9.9057 -9.5962 -9.3929 -9.3178 -8.9227 -8.4562 -8.2901 1.3071 1.5778 1.6409 1.8343 1.9300 2.1742 3.1367 3.3917 3.6591 3.7437 3.8020 3.9591 4.0897 4.1446 4.3529 4.3717 4.4863 4.6681 4.7769 4.8370 5.0141 5.0421 5.1418 5.2331 5.3179 5.5048 5.5070 5.6130 5.7192 5.8165 5.9091 5.9411 6.0759 6.1106 6.1848 6.2353 6.2430 6.4012 6.4820 6.5847 6.6226 6.7634 6.8058 6.8961 7.0725 7.0828 7.3218 7.4034 7.4857 7.6162 7.7153 7.8488 7.8778 7.9911 8.0877 8.1024 8.1943 8.3146 8.3694 8.4383 8.5761 8.5832 8.6714 8.7206 8.8377 9.0033 9.1927 9.2583 9.4078 9.4589 9.5665 9.6626 9.7368 9.8645 9.9382 10.0077 10.1061 10.2419 10.3190 10.4884 10.5309 10.6291 10.7131 10.8275 10.9962 11.0293 11.0677 11.1585 11.2666 11.2821 11.4044 11.5432 11.6577 11.7258 11.8371 11.9197 12.0181 12.0601 12.1670 12.3525 12.4016 12.4458 12.5301 12.6046 12.7333 12.8271 12.9424 12.9746 13.0990 13.2340 13.2958 13.3402 13.4589 13.4921 13.5109 13.5531 13.8024 13.8392 13.8537 14.0005 14.0464 14.1061 14.1867 14.2155 14.2546 14.3203 14.4179 14.5047 14.5735 14.6402 14.6999 14.7998 14.8642 14.9041 15.0308 15.1475 15.1666 15.2887 15.3740 15.4165 15.5541 15.6143 15.7077 15.7320 15.8265 15.8838 16.0462 16.1919 16.2178 16.3167 16.3838 16.4820 16.6054 16.7611 16.8137 16.9048 16.9690 17.0419 17.0835 17.2901 17.3854 17.4794 17.5481 17.6926 17.8436 17.9387 18.1894 18.2949 18.3183 18.4197 18.5257 18.7257 18.7957 19.0989 19.1839 19.3188 19.3967 19.5524 19.6705 19.7641 19.7865 19.8920 20.0480 20.1478 20.2301 20.3828 20.4383 20.4796 20.6881 20.7853 20.8308 20.9439 20.9912 21.0586 21.2565 21.3079 21.4318 21.4493 21.5436 21.8403 21.8928 21.9363 22.1006 22.2613 22.3540 22.4142 22.4757 22.5778 22.6900 22.7988 23.0241 23.1908 23.2954 23.3612 23.4293 23.6086 23.6470 23.8366 23.9171 23.9850 24.2460 24.2791 24.3916 24.5445 24.6636 24.7033 24.8073 24.9831 25.1418 25.2123 25.3134 25.3616 25.4518 25.5479 25.7304 25.8677 26.0316 26.1988 26.3675 26.3972 26.4731 26.6626 26.7758 26.8390 26.8786 27.0010 27.1246 27.2198 27.3418 27.4513 27.6086 27.6790 27.8463 28.0080 28.1342 28.2224 28.4196 28.5990 28.6202 28.7481 29.0387 29.1399 29.1968 29.3086 29.3915 29.4718 29.5902 29.8104 29.9281 30.0235 30.0730 30.2815 30.3410 30.4219 30.5291 30.6109 30.7003 30.9543 31.0105 31.0794 31.1984 31.3783 31.4885 31.5756 31.6181 31.8272 31.8797 32.0753 32.1302 32.2705 32.3512 32.4248 32.5593 32.7159 32.8968 32.9341 33.0995 33.1879 33.2558 33.3533 33.4285 33.5474 33.6603 33.8560 33.9182 33.9573 34.0139 34.1299 34.3440 34.4079 34.6663 34.7077 34.8057 34.8799 35.0543 35.1701 35.3103 35.3684 35.5350 35.6589 35.7659 35.8800 36.1598 36.1873 36.2461 36.5039 36.6107 36.7690 36.8404 36.9500 37.0387 37.1500 37.2874 37.3645 37.4787 37.5530 37.7355 37.8097 37.8420 38.1155 38.1965 38.2523 38.3507 38.4953 38.5297 38.6798 38.7165 38.8311 38.9169 39.0043 39.0611 39.1942 39.4353 39.4993 39.6828 39.6975 39.8502 39.9281 40.0413 40.1257 40.2753 40.3665 40.4189 40.6211 40.6780 40.7379 40.9921 41.0206 41.3119 41.4131 41.4558 41.5719 41.6007 41.6802 41.7641 41.9161 41.9371 42.1046 42.2302 42.2980 42.4584 42.5095 42.6068 42.7277 42.7810 43.0409 43.1101 43.1839 43.2822 43.3203 43.4804 43.6207 43.7263 43.8727 43.9820 44.0204 44.1952 44.3469 44.4594 44.5661 44.7907 44.8563 44.9287 45.0901 45.1920 45.3860 45.4913 45.5179 45.6298 45.6488 45.7962 45.9060 46.0666 46.2716 46.4141 46.5484 46.5956 46.7144 46.8663 46.9475 47.0388 47.2263 47.2984 47.4226 47.5604 47.7276 47.8333 47.9981 48.1093 48.2194 48.2764 48.5546 48.6055 48.8474 48.9671 49.0033 49.1045 49.2255 49.3633 49.5807 49.6284 49.6600 50.0241 50.1394 50.3007 50.3990 50.5478 50.9379 51.0288 51.1207 51.2377 51.4590 51.5245 51.7191 51.9987 52.1410 52.3698 52.6147 52.7877 53.1096 53.2209 53.3345 53.6087 53.7476 53.8654 53.9575 54.1054 54.2095 54.4500 54.6266 54.7957 55.1859 55.4749 55.9303 56.0011 56.0769 56.1870 56.4203 56.4776 56.6168 57.0359 57.1562 57.4026 57.5144 57.9125 57.9496 58.1253 58.3774 58.6665 58.7802 58.9116 59.0224 59.2802 59.4508 59.5738 59.7616 59.8858 60.3005 60.5028 60.5482 60.6894 61.1909 61.4032 61.4701 61.8748 62.0869 62.2837 62.3779 62.5578 62.7383 62.9867 63.1733 63.3254 63.7194 63.8298 64.1161 64.2474 64.4769 64.8841 65.0445 65.0513 65.1389 65.3249 65.4481 65.6836 65.8097 66.1746 66.2276 66.2686 66.6254 67.1044 67.5116 67.6218 67.6447 67.8197 68.0053 68.2256 68.3653 68.5716 68.6943 68.8661 69.3243 69.5638 69.7529 69.9902 70.1713 70.3515 70.7054 71.2917 71.3400 71.3717 71.6202 71.8406 72.4330 72.6438 72.6939 72.8008 73.0984 73.3433 73.5454 73.6485 73.8348 74.0302 74.1844 74.3532 74.4288 74.6520 74.8327 74.8828 75.0447 75.3850 75.4705 75.6952 75.9333 75.9706 76.2653 76.5222 76.6181 76.7123 76.7954 77.0295 77.2352 77.5609 77.6599 77.7055 77.7646 77.9231 78.0666 78.2293 78.4106 78.5318 78.6175 78.7200 78.8520 78.9734 79.0980 79.2147 79.3532 79.4405 79.5376 79.6488 79.6854 79.8449 79.9203 80.0350 80.0704 80.2135 80.3940 80.5313 80.6089 80.7366 80.8978 80.9178 81.0015 81.2176 81.2716 81.3952 81.5869 81.7233 81.9385 82.0511 82.1372 82.2263 82.2885 82.3710 82.5045 82.6969 82.7476 82.8568 83.0599 83.2620 83.3707 83.4308 83.5314 83.5922 83.7287 83.8364 83.8752 84.0838 84.0926 84.2372 84.3149 84.5150 84.6053 84.8673 85.0432 85.1225 85.1946 85.3354 85.4049 85.5179 85.6257 85.7318 85.7907 85.8283 85.9921 86.0251 86.0986 86.2420 86.3856 86.4207 86.5097 86.6173 86.7069 86.8646 86.9704 87.0609 87.1043 87.2619 87.4512 87.4657 87.6575 87.8104 87.8254 87.8917 88.0045 88.1636 88.3570 88.4617 88.5934 88.6947 88.8616 88.9191 88.9764 89.1318 89.1661 89.2704 89.4226 89.4511 89.5095 89.6143 89.7310 89.8048 89.9529 90.0204 90.1107 90.1692 90.2696 90.3793 90.4426 90.6452 90.6691 90.7603 90.8675 90.8822 91.0898 91.2701 91.3922 91.5933 91.6906 91.8722 92.0296 92.1245 92.2409 92.3881 92.5193 92.6460 92.7902 92.8019 92.8830 92.9966 93.1597 93.3767 93.4208 93.5243 93.6390 93.7087 93.8072 93.8806 93.9644 94.0417 94.0880 94.2920 94.4387 94.6440 94.7025 94.7537 94.8664 94.9478 95.1455 95.2501 95.3112 95.4330 95.6752 95.8073 95.8858 96.1000 96.1841 96.3027 96.3864 96.3988 96.4817 96.6042 96.6582 96.8059 96.9630 97.1009 97.2193 97.3487 97.4335 97.5797 97.6592 97.7754 97.9781 98.1604 98.3200 98.5090 98.5760 98.6581 98.7839 98.8578 98.8984 99.0253 99.1154 99.2726 99.3298 99.4299 99.5011 99.6160 99.7379 100.0313 100.1056 100.1419 100.2923 100.3504 100.5017 100.5446 100.6795 100.8918 100.9355 101.1207 101.1808 101.3346 101.6483 101.6979 101.8110 102.1326 102.2079 102.2619 102.4493 102.7230 102.7851 102.9031 103.0104 103.1697 103.5369 103.5648 103.6169 103.8370 103.9628 104.0878 104.3167 104.5387 104.6118 104.7365 104.8985 104.9976 105.3152 105.4396 105.5874 105.6391 105.7370 105.8310 105.9161 105.9863 106.2642 106.2902 106.4556 106.5267 106.5363 106.6973 106.9037 106.9890 107.1617 107.2444 107.4484 107.7645 107.8096 107.8795 107.9346 108.1463 108.3265 108.4371 108.6480 108.7652 108.8026 109.0155 109.0795 109.2337 109.3006 109.4126 109.4929 109.6299 109.9207 109.9627 110.2128 110.2831 110.3539 110.4174 110.5629 110.6734 111.0173 111.1196 111.3021 111.3783 111.4681 111.7277 111.8132 111.9118 111.9616 112.1659 112.2955 112.3569 112.5471 112.7823 112.9630 113.0103 113.1703 113.2879 113.4099 113.4557 113.6577 113.7788 114.0246 114.1164 114.3682 114.4180 114.5528 114.5933 114.6435 114.7607 114.8877 115.1385 115.2004 115.3351 115.3429 115.4652 115.6550 115.7349 115.8391 115.9193 116.0744 116.2802 116.3618 116.6256 116.7383 116.7930 116.8841 116.9509 117.1885 117.3011 117.3834 117.5266 117.7375 117.8103 117.8996 118.0029 118.1461 118.1818 118.2691 118.4109 118.4873 118.7972 118.8206 118.9660 119.0729 119.1226 119.2736 119.4153 119.4934 119.6490 119.7132 119.8185 119.8436 120.0522 120.0777 120.2706 120.3498 120.4833 120.6903 120.7159 120.9648 120.9921 121.1040 121.1804 121.2876 121.5590 121.6857 121.8936 122.0457 122.2412 122.3349 122.4870 122.5713 122.8075 123.3128 123.4954 123.5582 123.7100 123.9372 124.0850 124.2114 124.3558 124.6517 125.0214 125.2751 125.7845 126.2056 126.2255 126.4168 126.5309 126.8104 126.9444 127.0223 127.0339 127.1026 127.2758 127.4399 127.8201 127.8779 128.2577 128.3716 128.4162 128.5467 128.6982 129.0594 129.2515 129.4283 129.5323 129.7744 129.9090 130.0404 130.1058 130.4548 130.7783 130.8064 131.0790 131.3629 131.4691 131.5265 131.6286 131.8822 132.0880 132.1098 132.2528 132.3635 132.6026 132.7380 132.9793 133.0488 133.2393 133.5114 133.8193 134.1921 134.5180 134.7823 135.0871 135.2006 135.4990 135.6400 135.8848 135.9276 136.2004 136.4237 136.4985 136.6438 136.8821 137.1098 137.3466 137.7320 137.9169 138.0793 138.3222 138.5388 138.7571 138.8259 138.9717 139.0724 139.2031 139.5675 139.6892 140.2566 140.3441 140.5150 141.0402 141.2036 141.3734 141.4037 141.7276 142.1663 142.3566 142.3886 143.1392 143.2457 143.4436 143.5388 143.7673 143.9021 143.9755 144.2200 144.3764 144.5476 144.6044 144.9359 145.1006 145.2742 145.7827 145.9271 146.2850 146.6483 147.0657 147.1936 147.4764 147.8211 147.8789 148.0163 148.2025 148.4308 148.6972 148.8039 148.8995 148.9186 149.2432 149.3270 149.4176 149.6242 149.7638 150.1043 150.3113 150.3544 150.5735 150.8179 150.9815 151.1103 151.2018 151.4414 151.6823 151.9285 152.2500 152.4309 152.8635 153.0405 153.2106 153.4135 153.8276 154.4843 154.7093 155.0673 155.5451 155.6583 155.8680 156.0146 156.1362 156.3882 156.6261 156.8913 157.0260 157.1672 157.2815 157.4182 157.4825 157.8399 158.1092 158.2969 159.0391 159.2041 159.4028 159.5178 159.6147 160.1491 160.6049 161.2451 161.5118 161.8687 162.3839 163.5647 163.7280 164.0944 164.6160 167.9172 168.8001 169.6128 170.3140 171.7210 172.7372 174.1422 174.6613 176.5198 180.1577 181.1542 182.4319 186.1067 186.6699 187.5143 188.3677 188.8101 188.8705 189.4375 190.1703 190.7980 191.1215 192.3694 192.7474 193.8207 195.3671 195.9961 200.0228 201.7524 202.6352 205.8692 206.4892 207.9036 212.5164 229.8578 235.8708 241.0686 247.9925 248.9455 338.3365 617.6740 620.8713 624.0361 629.5885 630.3727 631.6875 632.3758 632.6611 634.4605 634.8408 635.3055 635.6784 636.8581 637.0656 637.2356 638.1129 639.3496 641.1137 643.1944 644.1091 645.6091 647.0782 654.0778 655.8399 658.1658 1213.4602 1214.7200 1563.1059 -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 Si F O O C C C C 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 H H H H H H H H H H H H H 0.478821 -0.220097 -0.345832 -0.342912 -0.277180 -0.121901 -0.132542 -0.466112 -0.428181 -0.084356 -0.165838 -0.115973 -0.001676 -0.239848 -0.299438 0.340688 -0.178402 -0.189743 0.190154 -0.176639 0.186314 0.036504 -0.267606 0.313028 -0.188954 -0.271967 -0.156028 -0.147048 -0.175626 0.096501 0.084953 0.094391 0.077449 0.101175 0.102651 0.100542 0.110002 0.103412 0.108752 0.095515 0.084190 0.137072 0.143251 0.143966 0.155533 0.133508 0.142438 0.149764 0.094950 0.111138 0.094567 0.085763 0.101558 0.155893 0.158792 0.161114 0.161098 0.158450 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 Si F O O C C C C 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 H H H H H H H H H H H H H 13.5212 9.2201 8.3458 8.3429 6.2772 6.1219 6.1325 6.4661 6.4282 6.0844 6.1658 6.1160 6.0017 6.2398 6.2994 5.6593 6.1784 6.1897 5.8098 6.1766 5.8137 5.9635 6.2676 5.6870 6.1890 6.2720 6.1560 6.1470 6.1756 0.9035 0.9150 0.9056 0.9226 0.8988 0.8973 0.8995 0.8900 0.8966 0.8912 0.9045 0.9158 0.8629 0.8567 0.8560 0.8445 0.8665 0.8576 0.8502 0.9050 0.8889 0.9054 0.9142 0.8984 0.8441 0.8412 0.8389 0.8389 0.8416 14.0000 9.0000 8.0000 8.0000 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 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 0.4788 -0.2201 -0.3458 -0.3429 -0.2772 -0.1219 -0.1325 -0.4661 -0.4282 -0.0844 -0.1658 -0.1160 -0.0017 -0.2398 -0.2994 0.3407 -0.1784 -0.1897 0.1902 -0.1766 0.1863 0.0365 -0.2676 0.3130 -0.1890 -0.2720 -0.1560 -0.1470 -0.1756 0.0965 0.0850 0.0944 0.0774 0.1012 0.1027 0.1005 0.1100 0.1034 0.1088 0.0955 0.0842 0.1371 0.1433 0.1440 0.1555 0.1335 0.1424 0.1498 0.0950 0.1111 0.0946 0.0858 0.1016 0.1559 0.1588 0.1611 0.1611 0.1584 4.0788 1.0650 2.0493 2.0668 3.8491 3.8651 3.6903 3.9062 3.8866 3.7424 3.9008 3.8180 3.6733 3.9052 3.9606 3.7597 3.8912 3.8967 3.6878 3.8796 4.0440 3.8430 3.9158 3.6484 3.8699 3.9349 3.8642 3.8395 3.8585 1.0086 1.0140 1.0082 1.0096 1.0118 1.0105 1.0126 1.0069 1.0111 1.0106 1.0151 1.0173 0.9943 0.9904 1.0021 1.0029 1.0108 1.0034 0.9980 0.9983 0.9922 1.0014 1.0039 1.0107 0.9978 0.9989 0.9900 0.9882 0.9902 4.0788 1.0650 2.0493 2.0668 3.8491 3.8651 3.6903 3.9062 3.8866 3.7424 3.9008 3.8180 3.6733 3.9052 3.9606 3.7597 3.8912 3.8967 3.6878 3.8796 4.0440 3.8430 3.9158 3.6484 3.8699 3.9349 3.8642 3.8395 3.8585 1.0086 1.0140 1.0082 1.0096 1.0118 1.0105 1.0126 1.0069 1.0111 1.0106 1.0151 1.0173 0.9943 0.9904 1.0021 1.0029 1.0108 1.0034 0.9980 0.9983 0.9922 1.0014 1.0039 1.0107 0.9978 0.9989 0.9900 0.9882 0.9902 0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.9473 0.9745 0.9528 0.9536 1.0741 1.0845 0.8860 0.9392 0.9470 0.9294 0.9818 0.9824 0.8964 0.9919 1.0191 1.3593 1.2852 0.9756 0.9775 0.9793 0.9729 0.9794 0.9725 0.8727 0.9896 1.0198 1.4393 0.9784 1.4548 1.0045 1.3629 1.3695 1.3198 0.9814 1.3324 0.9854 1.3893 0.9594 1.4055 0.9864 1.3637 1.4319 0.9862 0.9451 0.9937 0.9827 0.9918 0.9878 0.9866 1.3367 1.3598 1.4060 0.9776 1.4001 0.9923 1.3954 0.9853 1.3782 0.9955 0.9961 0 4 0 6 0 7 0 8 1 20 2 15 2 21 3 18 3 23 4 5 4 29 4 30 5 9 5 31 5 32 6 10 6 11 7 33 7 34 7 35 8 36 8 37 8 38 9 12 9 39 9 40 10 13 10 41 11 14 11 42 12 16 12 17 13 15 13 43 14 15 14 44 16 18 16 45 17 19 17 46 18 20 19 20 19 47 21 22 21 48 21 49 22 50 22 51 22 52 23 24 23 25 24 26 24 53 25 27 25 54 26 28 26 55 27 28 27 56 28 57 -0.034124396 -1510.085614087165 -20.91228 19.91440 -0.99788 24.49252 -23.52984 0.96268 9.62197 -9.06082 0.56115 1.49579 3.80200