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:-2.8343,1.3869,.3162;1.0587,-4.9909,.7768;2.4068,3.8288,2.1063;1.708,-3.1298,-1.0219;-2.3517,-.1358,-.6872;-3.4961,-1.0833,-1.0362;-1.2347,2.211,.8704;-3.8124,.8491,1.8322;-3.8457,2.5818,-.7227;-3.0655,-2.2795,-1.8999;-.7805,3.4133,.3341;-.4166,1.6015,1.8313;-1.9735,-3.0763,-1.2473;.426,3.9931,.716;.7851,2.1566,2.2289;1.2193,3.361,1.6691;-.6406,-2.7723,-1.5076;-2.2627,-4.0613,-.3066;.3847,-3.3962,-.8129;-1.2448,-4.7209,.3671;.066,-4.3739,.1179;2.9419,5.0103,1.5201;4.3002,5.257,2.1264;2.115,-1.8356,-1.2484;3.1801,-1.6646,-2.1209;1.5372,-.7442,-.6106;3.6678,-.3874,-2.3606;2.0214,.5287,-.8781;3.0858,.7147,-1.7498;-1.8386,.1937,-1.5993;-1.5946,-.6701,-.1029;-4.2835,-.5464,-1.5739;-3.9584,-1.4589,-.1181;-4.0432,1.6953,2.4826;-4.7619,.3874,1.551;-3.2623,.1173,2.4286;-4.1298,3.473,-.1594;-3.3048,2.911,-1.6126;-4.7691,2.108,-1.0644;-3.9341,-2.9152,-2.0868;-2.7234,-1.9118,-2.8707;-1.3736,3.9341,-.4093;-.7157,.6619,2.284;.7233,4.9292,.2629;1.4007,1.6611,2.9699;-.4034,-2.017,-2.2475;-3.2926,-4.3182,-.0923;-1.4658,-5.491,1.095;2.2781,5.8601,1.7084;3.0251,4.8881,.4351;4.7268,6.1632,1.6968;4.2403,5.3973,3.2059;4.9867,4.4357,1.9196;3.625,-2.5237,-2.6064;.7181,-.8699,.086;4.5009,-.2573,-3.0386;1.5625,1.38,-.3914;3.4598,1.7102,-1.9481; 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 2888.6511631381 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 6.415e-06 Time for diagonalization 0.386 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.395 sec Total time needed 0.790 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:-2.8343,1.3869,.3162;1.0587,-4.9909,.7768;2.4068,3.8288,2.1063;1.708,-3.1298,-1.0219;-2.3517,-.1358,-.6872;-3.4961,-1.0833,-1.0362;-1.2347,2.211,.8704;-3.8124,.8491,1.8322;-3.8457,2.5818,-.7227;-3.0655,-2.2795,-1.8999;-.7805,3.4133,.3341;-.4166,1.6015,1.8313;-1.9735,-3.0763,-1.2473;.426,3.9931,.716;.7851,2.1566,2.2289;1.2193,3.361,1.6691;-.6406,-2.7723,-1.5076;-2.2627,-4.0613,-.3067;.3847,-3.3962,-.8129;-1.2448,-4.7209,.3671;.066,-4.3739,.1179;2.9419,5.0103,1.5201;4.3002,5.257,2.1264;2.115,-1.8356,-1.2484;3.1801,-1.6646,-2.1209;1.5372,-.7442,-.6106;3.6678,-.3874,-2.3606;2.0214,.5287,-.8781;3.0858,.7147,-1.7498;-1.8386,.1937,-1.5993;-1.5946,-.6701,-.1029;-4.2835,-.5464,-1.5739;-3.9584,-1.4589,-.1181;-4.0432,1.6953,2.4826;-4.7619,.3874,1.551;-3.2623,.1173,2.4286;-4.1298,3.473,-.1594;-3.3048,2.911,-1.6126;-4.7691,2.108,-1.0644;-3.9341,-2.9152,-2.0868;-2.7234,-1.9118,-2.8707;-1.3736,3.9341,-.4093;-.7157,.6619,2.284;.7233,4.9292,.2629;1.4007,1.6611,2.9699;-.4034,-2.017,-2.2475;-3.2926,-4.3182,-.0923;-1.4658,-5.491,1.095;2.2781,5.8601,1.7084;3.0251,4.8881,.4351;4.7268,6.1632,1.6968;4.2403,5.3973,3.2059;4.9867,4.4357,1.9196;3.625,-2.5237,-2.6064;.7181,-.8699,.086;4.5009,-.2573,-3.0386;1.5625,1.38,-.3914;3.4598,1.7102,-1.9481; 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:-2.8343,1.3869,.3162;1.0587,-4.9909,.7768;2.4068,3.8288,2.1063;1.708,-3.1298,-1.0219;-2.3517,-.1358,-.6872;-3.4961,-1.0833,-1.0362;-1.2347,2.211,.8704;-3.8124,.8491,1.8322;-3.8457,2.5818,-.7227;-3.0655,-2.2795,-1.8999;-.7805,3.4133,.3341;-.4166,1.6015,1.8313;-1.9735,-3.0763,-1.2473;.426,3.9931,.716;.7851,2.1566,2.2289;1.2193,3.361,1.6691;-.6406,-2.7723,-1.5076;-2.2627,-4.0613,-.3066;.3847,-3.3962,-.8129;-1.2448,-4.7209,.3671;.066,-4.3739,.1179;2.9419,5.0103,1.5201;4.3002,5.257,2.1264;2.115,-1.8356,-1.2484;3.1801,-1.6646,-2.1209;1.5372,-.7442,-.6106;3.6678,-.3874,-2.3606;2.0214,.5287,-.8781;3.0858,.7147,-1.7498;-1.8386,.1937,-1.5993;-1.5946,-.6701,-.1029;-4.2835,-.5464,-1.5739;-3.9584,-1.4589,-.1181;-4.0432,1.6953,2.4826;-4.7619,.3874,1.551;-3.2623,.1173,2.4286;-4.1298,3.473,-.1594;-3.3048,2.911,-1.6126;-4.7691,2.108,-1.0644;-3.9341,-2.9152,-2.0868;-2.7234,-1.9118,-2.8707;-1.3736,3.9341,-.4093;-.7157,.6619,2.284;.7233,4.9292,.2629;1.4007,1.6611,2.9699;-.4034,-2.017,-2.2475;-3.2926,-4.3182,-.0923;-1.4658,-5.491,1.095;2.2781,5.8601,1.7084;3.0251,4.8881,.4351;4.7268,6.1632,1.6968;4.2403,5.3973,3.2059;4.9867,4.4357,1.9196;3.625,-2.5237,-2.6064;.7181,-.8699,.086;4.5009,-.2573,-3.0386;1.5625,1.38,-.3914;3.4598,1.7102,-1.9481; 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 3383 GEPOL Volume 2914.3646 GEPOL Surface-area 1630.9309 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 0.7s) Overall time for CPCM initialization 0.8s -1510.05397328 2888.65116314 -4398.70513642 -7807.47164667 3408.76651025 -0.02747978 -3013.96024871 1503.90627543 2.00408782 109.000166122562 109.000166122562 218.000332245125 -135.231286561182 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 -1800.5562 -674.9035 -524.7415 -524.1939 -281.9803 -281.6292 -281.5802 -281.4024 -280.8954 -279.9454 -279.8847 -279.8028 -279.7959 -279.7686 -279.7590 -279.7229 -279.7217 -279.7153 -279.6967 -279.6133 -279.5500 -279.5268 -279.3768 -279.3577 -279.1762 -279.1369 -278.7355 -278.6740 -278.6546 -145.6212 -100.6882 -100.6729 -100.6665 -36.7798 -32.9944 -32.3602 -27.0466 -26.6177 -26.4363 -24.9400 -24.2692 -24.1519 -23.6614 -23.5163 -23.4637 -23.0724 -22.8046 -22.0205 -21.3743 -21.3317 -20.6513 -20.4146 -19.9167 -19.6102 -19.3775 -19.2309 -18.6941 -18.3696 -17.9619 -17.5265 -17.4565 -16.8523 -16.3454 -16.0989 -16.0543 -15.9597 -15.6393 -15.6274 -15.4298 -14.8524 -14.8173 -14.7080 -14.6581 -14.5219 -14.3230 -14.2141 -14.0464 -14.0328 -13.7571 -13.6700 -13.6131 -13.4661 -13.3524 -13.2920 -13.2118 -12.9713 -12.9233 -12.8516 -12.6251 -12.5182 -12.4281 -12.3620 -12.1851 -12.1534 -12.0134 -11.6421 -11.5062 -11.3345 -11.2522 -11.2016 -10.4449 -10.3400 -9.9594 -9.5796 -9.4434 -9.3053 -8.9408 -8.4070 -8.3118 1.3323 1.5638 1.6796 1.8368 1.9608 2.1602 3.0412 3.2932 3.5991 3.7353 3.7964 4.0292 4.1414 4.2270 4.4137 4.5497 4.5683 4.6297 4.7297 4.9656 4.9832 5.1219 5.1593 5.2680 5.3083 5.4612 5.5028 5.5822 5.6396 5.8212 5.8499 5.9319 6.0063 6.0946 6.2117 6.2621 6.2988 6.3389 6.5047 6.5935 6.6758 6.7418 6.8383 6.8575 6.9020 7.0761 7.1037 7.1756 7.3775 7.4152 7.4526 7.5895 7.7018 7.8132 7.9632 8.0486 8.1174 8.2418 8.2864 8.5079 8.5204 8.5831 8.6648 8.7179 8.7822 8.8829 9.0298 9.1032 9.1454 9.2469 9.4175 9.5642 9.6328 9.7354 9.8581 9.9171 10.0474 10.0855 10.1967 10.3312 10.4484 10.5163 10.6136 10.7493 10.8116 10.9541 11.0116 11.0816 11.1890 11.3234 11.3805 11.4132 11.4599 11.6091 11.7107 11.7744 11.9152 11.9917 12.1278 12.2147 12.3362 12.3972 12.6009 12.6500 12.6774 12.7542 12.8457 12.9611 13.0272 13.1049 13.1926 13.2039 13.3252 13.4343 13.5304 13.5797 13.6793 13.7124 13.7818 13.8007 13.9341 13.9602 14.0306 14.1045 14.1637 14.2839 14.3214 14.4333 14.4718 14.5450 14.6025 14.6763 14.7820 14.8743 14.9369 15.0709 15.1899 15.2938 15.3381 15.4164 15.4409 15.5226 15.5737 15.7022 15.7868 15.8467 15.9746 16.0477 16.0757 16.1750 16.2195 16.3245 16.3888 16.5190 16.5415 16.6578 16.6890 16.8359 16.9180 17.0019 17.2269 17.3544 17.4175 17.5420 17.5885 17.8351 17.8578 18.0860 18.1787 18.3056 18.4000 18.5605 18.6710 18.7356 18.7702 18.9711 19.2026 19.2253 19.3717 19.4575 19.6153 19.7782 19.8059 19.9626 20.0407 20.1066 20.2159 20.3483 20.4382 20.5848 20.6929 20.7208 20.8631 20.9411 21.1280 21.1859 21.2946 21.4397 21.4868 21.6844 21.8409 21.8702 21.9101 22.1200 22.2769 22.3408 22.3984 22.5801 22.7275 22.8908 22.9550 23.0271 23.0747 23.1649 23.2995 23.4427 23.5860 23.7778 23.8135 23.9081 23.9904 24.1118 24.2185 24.3691 24.5072 24.7435 24.8103 24.8344 24.9295 25.0877 25.2166 25.2659 25.3656 25.5020 25.6256 25.7678 25.8255 25.9868 26.0823 26.3387 26.4517 26.5141 26.5555 26.6290 26.8640 26.9420 26.9981 27.1599 27.2385 27.3580 27.4799 27.5893 27.6962 27.8581 27.9108 27.9658 28.2560 28.4144 28.4615 28.6198 28.8678 28.8954 29.0847 29.0939 29.2423 29.3705 29.4397 29.5274 29.5578 29.6677 29.7816 29.7970 29.9026 30.0250 30.2441 30.3101 30.3128 30.3887 30.5523 30.7462 30.9502 31.0012 31.1851 31.3333 31.4827 31.5095 31.5997 31.8391 31.9640 32.0509 32.1440 32.2927 32.3328 32.4578 32.5457 32.6282 32.6948 32.8752 33.1144 33.1514 33.2817 33.4746 33.5689 33.6543 33.7257 33.7799 33.8619 33.9724 34.0840 34.2432 34.3410 34.5055 34.7231 34.7695 34.8597 35.0026 35.1623 35.2264 35.2653 35.3715 35.5065 35.7538 35.8780 35.9736 36.0518 36.2318 36.3532 36.4551 36.5774 36.7301 36.7643 36.9168 37.0064 37.0656 37.3142 37.4240 37.4486 37.5138 37.6885 37.8625 38.0163 38.0293 38.2264 38.3185 38.4633 38.5184 38.5331 38.6596 38.7936 38.9052 39.0625 39.0710 39.1479 39.3206 39.4178 39.5199 39.6113 39.6740 39.8832 40.0503 40.0916 40.2068 40.3086 40.4146 40.5415 40.6904 40.7361 40.8048 41.0808 41.1738 41.2945 41.3497 41.4796 41.5406 41.6725 41.7665 41.8582 41.9554 42.0293 42.1956 42.2951 42.3600 42.5002 42.5678 42.7228 42.8330 42.9032 43.0620 43.1071 43.2837 43.3782 43.4288 43.6405 43.8203 43.8610 44.0305 44.1341 44.1724 44.2092 44.4438 44.4957 44.5412 44.7119 44.8360 44.9473 45.0915 45.2720 45.3133 45.3260 45.4119 45.5420 45.7422 45.8160 45.9605 46.0494 46.1461 46.3015 46.4616 46.5995 46.6999 46.8642 46.9238 47.0185 47.1555 47.2698 47.2989 47.6730 47.7715 47.8452 48.0435 48.1679 48.2734 48.4498 48.5528 48.6925 48.8452 49.0612 49.0878 49.2790 49.4263 49.5367 49.6202 49.6993 49.7932 49.9007 50.0103 50.3704 50.7169 50.8463 51.1030 51.1951 51.3024 51.4813 51.6854 51.8513 51.9862 52.1813 52.3437 52.4308 52.5346 52.7543 52.8810 53.1114 53.3411 53.5787 53.8575 53.9564 54.1389 54.4183 54.4748 54.5844 55.1341 55.3675 55.4618 55.6067 55.7280 55.9613 56.3746 56.6820 56.9275 56.9920 57.1640 57.3492 57.4772 57.5078 57.8058 57.9408 58.1983 58.2462 58.5038 58.7334 58.8860 58.9100 59.0407 59.2185 59.5048 59.6370 59.9918 60.1892 60.2940 60.8197 60.8347 60.9347 61.0450 61.3089 61.5648 61.7758 62.0126 62.2200 62.3232 62.6771 63.1236 63.2172 63.4685 63.6535 63.7984 63.9545 64.1474 64.4116 64.5136 64.6074 65.0499 65.2134 65.4320 65.4663 65.9377 66.0569 66.2743 66.5116 66.6643 66.7572 67.2583 67.4735 67.5996 67.6582 67.7382 67.9795 68.3302 68.3573 68.7561 68.8421 69.1127 69.1965 69.5259 69.6711 70.2530 70.4006 70.5094 71.0117 71.1933 71.3599 71.6155 71.8819 71.9222 72.2423 72.3134 72.7032 72.8401 73.0794 73.2830 73.5008 73.5354 73.8792 74.0207 74.2281 74.3548 74.4549 74.7072 75.0574 75.1137 75.3193 75.5292 75.6189 75.8318 76.0069 76.2728 76.3918 76.5702 76.7113 76.8563 76.9192 77.2388 77.3156 77.4986 77.5880 77.6228 77.8175 77.8850 78.1922 78.3519 78.4593 78.5676 78.8086 78.9160 79.0691 79.1363 79.1717 79.2058 79.3417 79.3975 79.5069 79.6784 79.7122 79.8279 79.8669 79.9205 80.0395 80.1223 80.2797 80.3992 80.4252 80.5896 80.7802 80.8927 80.8955 81.1360 81.2576 81.3429 81.5779 81.6283 81.6658 81.9772 82.0451 82.1385 82.2258 82.4538 82.6924 82.7800 82.9379 83.0598 83.1568 83.2616 83.3201 83.4883 83.5520 83.7267 83.7995 84.0795 84.0998 84.1753 84.2739 84.3944 84.4372 84.5499 84.6232 84.7713 84.8658 84.9059 85.0819 85.2611 85.3394 85.3714 85.4158 85.5701 85.6829 85.7587 85.8635 85.9880 86.0904 86.1141 86.2097 86.3860 86.4540 86.6374 86.6526 86.7842 86.8621 87.0168 87.1542 87.2917 87.4407 87.5469 87.6874 87.7410 87.8546 87.9668 88.0234 88.0474 88.2816 88.3571 88.4642 88.5630 88.6224 88.8579 88.8721 88.9909 89.1025 89.2472 89.3612 89.4171 89.5122 89.6297 89.6857 89.7641 89.8882 89.9339 90.0738 90.1851 90.2639 90.3283 90.4758 90.6054 90.6666 90.8322 90.9150 91.1111 91.1920 91.4090 91.5033 91.6109 91.7445 91.8474 91.9298 92.1365 92.2110 92.3611 92.4943 92.5803 92.6207 92.7568 92.9428 93.0474 93.0927 93.1672 93.2326 93.5218 93.6474 93.6974 93.8106 93.8629 93.9622 94.0235 94.1696 94.2787 94.4790 94.5117 94.7375 94.7461 94.8676 95.0140 95.0290 95.2159 95.3766 95.4350 95.5558 95.6491 95.7737 95.9330 96.0377 96.0904 96.2030 96.4011 96.5383 96.6824 96.6924 96.8698 96.9066 97.0270 97.2487 97.2964 97.4556 97.6446 97.7656 97.8899 98.0100 98.0531 98.2082 98.3374 98.3721 98.5991 98.6531 98.7416 98.9655 99.0704 99.2144 99.3105 99.4092 99.5398 99.6442 99.7110 99.8439 99.9337 100.0123 100.2208 100.3311 100.4512 100.4672 100.7759 100.9898 101.0328 101.1639 101.1969 101.3491 101.5307 101.6101 101.8381 102.0301 102.1485 102.3046 102.3988 102.8824 103.0859 103.1447 103.3242 103.3809 103.4182 103.5864 103.7293 104.0512 104.0728 104.2301 104.3194 104.5526 104.6194 104.8711 104.9685 105.0989 105.1699 105.3602 105.4864 105.6177 105.6751 105.6990 105.7625 105.9181 105.9867 106.2891 106.4002 106.6740 106.9064 107.0006 107.0806 107.1420 107.2298 107.3064 107.3857 107.4936 107.6300 107.6861 107.8079 107.8899 108.2310 108.2370 108.3037 108.4395 108.5342 108.7087 108.8830 109.0565 109.1588 109.3814 109.4575 109.4657 109.6258 109.7142 109.9100 109.9605 110.2392 110.2892 110.3521 110.5247 110.8298 111.0451 111.1216 111.3208 111.3358 111.5789 111.6303 111.7637 111.8049 111.8706 111.9984 112.1233 112.3611 112.4528 112.5582 112.6961 112.8384 113.0399 113.1548 113.4361 113.6023 113.7581 113.8437 113.9643 114.1101 114.1368 114.3592 114.4673 114.5415 114.6336 114.6969 114.8188 115.0659 115.1530 115.3976 115.4487 115.5121 115.7424 115.8446 115.9492 116.0487 116.2379 116.3023 116.3624 116.4956 116.6430 116.8855 116.9426 117.1271 117.2291 117.3173 117.4072 117.5047 117.5202 117.7146 117.8359 117.9847 118.0175 118.2917 118.3690 118.5507 118.6947 118.7862 118.8460 118.9354 119.0792 119.2407 119.2584 119.3968 119.4583 119.6292 119.6326 119.7189 119.8212 120.0379 120.1519 120.1950 120.3542 120.3903 120.5640 120.7257 120.8893 120.9631 121.2609 121.3533 121.4789 121.5574 121.8167 122.0713 122.2001 122.3512 122.4952 122.6528 122.7093 122.8905 123.0421 123.3074 123.4709 123.9781 124.0669 124.3523 124.6992 124.9343 125.1406 125.3128 125.9408 126.0050 126.1864 126.5133 126.6191 126.8140 126.9765 127.0850 127.1958 127.2498 127.4507 127.5955 127.6231 127.8472 128.0109 128.1041 128.2055 128.4348 128.6115 128.7753 128.9405 129.3664 129.3746 129.7528 129.9046 130.0740 130.4537 130.5277 130.6152 130.7665 130.9789 131.2608 131.5393 131.7067 131.8681 131.9632 132.0104 132.1139 132.2480 132.3384 132.6050 132.8752 133.1073 133.2853 133.4900 133.6673 134.0019 134.1542 134.3081 134.5117 134.5524 134.8389 135.2396 135.4509 135.5962 136.0093 136.1533 136.5268 136.6721 136.7032 136.8347 136.9914 137.1539 137.6287 137.7766 137.9732 138.2960 138.4961 138.6836 138.7578 138.7815 139.0229 139.4621 139.7251 139.9181 140.2134 140.2687 140.3628 140.5035 140.5915 141.1452 141.5759 141.6362 141.8697 142.0245 142.4589 142.9389 143.1943 143.3538 143.5979 143.7319 143.7686 143.9002 144.0304 144.1561 144.5340 144.7180 144.7784 144.9796 145.1604 145.2746 146.2760 146.5431 146.8401 147.0197 147.1766 147.3584 147.6182 147.8713 147.9527 148.1916 148.2983 148.3783 148.4267 148.7324 148.7777 148.8758 149.0571 149.4010 149.4932 149.6710 149.8307 150.0375 150.1252 150.3861 150.6193 150.8266 150.8854 151.1708 151.5079 151.6628 151.9444 152.1832 152.3327 152.7089 153.3181 153.4601 153.8057 153.8405 154.0009 154.3784 154.9384 155.1517 155.4940 155.8680 155.9280 156.1556 156.3353 156.6056 156.6405 156.9694 157.0931 157.2049 157.3118 157.5414 157.7430 157.7980 157.9281 158.0994 158.4396 158.9326 159.0193 159.2065 159.4356 160.7369 161.6337 161.8058 162.1214 162.5777 162.7873 163.3481 164.3489 164.8910 168.4648 168.5605 169.4535 170.3658 171.6971 172.6294 173.9107 174.0458 176.2447 179.4966 180.1043 182.4751 186.3649 186.5105 186.9105 188.1108 188.7178 189.0966 189.4387 190.1067 190.1388 191.1515 192.7101 192.7364 193.0227 195.2623 195.9309 200.0216 202.0089 203.3348 205.7567 206.4654 207.5476 212.5282 229.8445 235.8219 241.0529 247.9506 248.7991 339.5402 618.3562 619.0532 623.6023 629.8055 630.2793 631.3526 632.3291 632.4599 634.4156 634.5066 634.9766 635.5285 636.9261 637.3808 637.5788 639.2952 639.7048 640.5266 643.0418 643.4598 645.6471 646.6234 654.0095 655.5962 658.1389 1213.7931 1214.7042 1563.0825 -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 0.515582 -0.221060 -0.338446 -0.343352 -0.219194 -0.157876 -0.162440 -0.439751 -0.450817 -0.092780 -0.145514 -0.149047 0.057867 -0.228833 -0.290719 0.340466 -0.262594 -0.222121 0.248391 -0.163029 0.169638 0.066320 -0.274522 0.323252 -0.271291 -0.249817 -0.094066 -0.039590 -0.260329 0.089562 0.060014 0.082466 0.083115 0.109738 0.106281 0.107192 0.109895 0.103635 0.106719 0.091840 0.086755 0.143339 0.139195 0.139230 0.133589 0.151042 0.145547 0.150243 0.095242 0.094246 0.090278 0.087413 0.086935 0.146629 0.180315 0.160884 0.117443 0.156893 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 13.4844 9.2211 8.3384 8.3434 6.2192 6.1579 6.1624 6.4398 6.4508 6.0928 6.1455 6.1490 5.9421 6.2288 6.2907 5.6595 6.2626 6.2221 5.7516 6.1630 5.8304 5.9337 6.2745 5.6767 6.2713 6.2498 6.0941 6.0396 6.2603 0.9104 0.9400 0.9175 0.9169 0.8903 0.8937 0.8928 0.8901 0.8964 0.8933 0.9082 0.9132 0.8567 0.8608 0.8608 0.8664 0.8490 0.8545 0.8498 0.9048 0.9058 0.9097 0.9126 0.9131 0.8534 0.8197 0.8391 0.8826 0.8431 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 0.5156 -0.2211 -0.3384 -0.3434 -0.2192 -0.1579 -0.1624 -0.4398 -0.4508 -0.0928 -0.1455 -0.1490 0.0579 -0.2288 -0.2907 0.3405 -0.2626 -0.2221 0.2484 -0.1630 0.1696 0.0663 -0.2745 0.3233 -0.2713 -0.2498 -0.0941 -0.0396 -0.2603 0.0896 0.0600 0.0825 0.0831 0.1097 0.1063 0.1072 0.1099 0.1036 0.1067 0.0918 0.0868 0.1433 0.1392 0.1392 0.1336 0.1510 0.1455 0.1502 0.0952 0.0942 0.0903 0.0874 0.0869 0.1466 0.1803 0.1609 0.1174 0.1569 4.1012 1.0630 2.0640 2.0753 3.8049 3.9229 3.7258 3.8869 3.9247 3.8515 3.8927 3.8423 3.6005 3.8702 3.9943 3.7183 3.9087 3.9110 3.6384 3.8711 4.0713 3.7922 3.9727 3.7072 4.0181 3.8992 3.8538 3.7581 4.0044 1.0143 1.0283 1.0108 1.0015 1.0087 1.0058 1.0068 1.0080 1.0082 1.0101 1.0079 1.0097 0.9902 0.9941 1.0126 1.0156 1.0007 1.0008 0.9972 0.9864 0.9867 1.0055 1.0033 1.0036 1.0078 0.9804 0.9871 1.0178 0.9938 4.1012 1.0630 2.0640 2.0753 3.8049 3.9229 3.7258 3.8869 3.9247 3.8515 3.8927 3.8423 3.6005 3.8702 3.9943 3.7183 3.9087 3.9110 3.6384 3.8711 4.0713 3.7922 3.9727 3.7072 4.0181 3.8992 3.8538 3.7581 4.0044 1.0143 1.0283 1.0108 1.0015 1.0087 1.0058 1.0068 1.0080 1.0082 1.0101 1.0079 1.0097 0.9902 0.9941 1.0126 1.0156 1.0007 1.0008 0.9972 0.9864 0.9867 1.0055 1.0033 1.0036 1.0078 0.9804 0.9871 1.0178 0.9938 -0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.9527 1.0050 0.9488 0.9762 1.0620 1.0861 0.8769 0.9566 0.9435 0.9214 0.9720 0.9763 0.9345 1.0026 1.0112 1.3491 1.2942 0.9717 0.9739 0.9769 0.9748 0.9736 0.9729 0.8862 1.0103 1.0217 1.4396 0.9728 1.4735 0.9969 1.3335 1.3746 1.3112 0.9753 1.3122 1.0114 1.3489 0.9755 1.4056 0.9856 1.3812 1.4361 0.9855 0.9669 0.9740 0.9733 0.9903 0.9937 0.9938 1.3842 1.3762 1.4240 0.9870 1.3598 0.9445 1.4151 0.9798 1.4257 0.9750 0.9898 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 -0.031372767 -1510.085346047961 -14.39197 13.40559 -0.98638 31.80694 -30.09489 1.71205 -0.41782 -0.45039 -0.86822 2.15820 5.48572