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:-3.6719,1.3528,.6117;1.234,-3.912,1.423;2.2002,2.3225,1.7143;1.9131,-1.7801,.0293;-3.7079,-.3081,-.2831;-2.9692,-.2963,-1.6211;-1.8548,1.7148,.952;-4.6193,1.2065,2.2311;-4.4006,2.7333,-.4365;-2.5438,-1.6892,-2.0959;-1.0463,.7573,1.5792;-1.237,2.9025,.5689;-1.5363,-2.3192,-1.1728;.2973,.9765,1.8178;.1137,3.1478,.7961;.8883,2.1824,1.4319;-.2652,-1.7572,-1.0527;-1.8566,-3.4236,-.3916;.6704,-2.2962,-.1843;-.9302,-3.9668,.4906;.3215,-3.4029,.5807;2.904,3.4427,1.1882;4.3595,3.2928,1.5531;2.5879,-1.1382,-.98;2.6402,-1.6368,-2.2751;3.2822,.01,-.631;3.3895,-.9596,-3.2267;4.0348,.6715,-1.5907;4.0877,.1936,-2.8927;-3.2461,-1.0334,.3974;-4.7365,-.6546,-.4229;-2.0744,.3322,-1.5639;-3.6021,.161,-2.3856;-5.6639,.9435,2.0518;-4.1959,.4331,2.8747;-4.6084,2.1424,2.7922;-5.4534,2.5377,-.6504;-4.3507,3.6977,.0729;-3.8891,2.8416,-1.3945;-3.4211,-2.3355,-2.1741;-2.1197,-1.6098,-3.1004;-1.4674,-.1936,1.888;-1.8106,3.6764,.0719;.8984,.2186,2.3054;.5372,4.0904,.4769;-.0088,-.8862,-1.6443;-2.841,-3.8678,-.4643;-1.179,-4.8255,1.1004;2.5004,4.3713,1.6036;2.7823,3.4844,.1008;4.9178,4.1414,1.16;4.5019,3.273,2.6334;4.7892,2.3849,1.129;2.1105,-2.5409,-2.547;3.2399,.3762,.3855;3.4306,-1.3449,-4.2369;4.5779,1.5659,-1.3136;4.6719,.7121,-3.6408; 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 2966.2876328102 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 5.622e-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 0.420 sec Total time needed 0.814 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:-3.6719,1.3528,.6117;1.234,-3.912,1.423;2.2002,2.3225,1.7143;1.9131,-1.7801,.0293;-3.7079,-.3081,-.2831;-2.9692,-.2963,-1.6211;-1.8548,1.7148,.952;-4.6193,1.2065,2.2311;-4.4006,2.7333,-.4365;-2.5438,-1.6892,-2.0959;-1.0463,.7573,1.5792;-1.237,2.9025,.5689;-1.5363,-2.3192,-1.1728;.2973,.9765,1.8178;.1137,3.1478,.7961;.8883,2.1824,1.4319;-.2652,-1.7572,-1.0527;-1.8566,-3.4236,-.3916;.6704,-2.2962,-.1843;-.9302,-3.9668,.4906;.3215,-3.4029,.5807;2.904,3.4427,1.1882;4.3595,3.2928,1.5531;2.5879,-1.1382,-.98;2.6402,-1.6368,-2.2751;3.2822,.01,-.631;3.3895,-.9596,-3.2267;4.0348,.6715,-1.5907;4.0877,.1936,-2.8927;-3.2461,-1.0334,.3974;-4.7365,-.6546,-.4229;-2.0744,.3322,-1.5639;-3.6021,.161,-2.3856;-5.6639,.9436,2.0518;-4.1959,.4331,2.8747;-4.6084,2.1424,2.7922;-5.4534,2.5377,-.6504;-4.3507,3.6977,.0729;-3.8891,2.8416,-1.3945;-3.4211,-2.3355,-2.1741;-2.1197,-1.6098,-3.1004;-1.4674,-.1936,1.888;-1.8106,3.6764,.0719;.8984,.2186,2.3054;.5372,4.0905,.4769;-.0088,-.8862,-1.6443;-2.841,-3.8678,-.4643;-1.179,-4.8255,1.1004;2.5004,4.3713,1.6036;2.7823,3.4844,.1008;4.9178,4.1414,1.16;4.5019,3.273,2.6334;4.7892,2.3849,1.129;2.1105,-2.5409,-2.547;3.2399,.3762,.3855;3.4306,-1.3449,-4.2369;4.5779,1.566,-1.3136;4.6719,.7121,-3.6408; 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:-3.6719,1.3528,.6117;1.234,-3.912,1.423;2.2002,2.3225,1.7143;1.9131,-1.7801,.0293;-3.7079,-.3081,-.2831;-2.9692,-.2963,-1.6211;-1.8548,1.7148,.952;-4.6193,1.2065,2.2311;-4.4006,2.7333,-.4365;-2.5438,-1.6892,-2.0959;-1.0463,.7573,1.5792;-1.237,2.9025,.5689;-1.5363,-2.3192,-1.1728;.2973,.9765,1.8178;.1137,3.1478,.7961;.8883,2.1824,1.4319;-.2652,-1.7572,-1.0527;-1.8566,-3.4236,-.3916;.6704,-2.2962,-.1843;-.9302,-3.9668,.4906;.3215,-3.4029,.5807;2.904,3.4427,1.1882;4.3595,3.2928,1.5531;2.5879,-1.1382,-.98;2.6402,-1.6368,-2.2751;3.2822,.01,-.631;3.3895,-.9596,-3.2267;4.0348,.6715,-1.5907;4.0877,.1936,-2.8927;-3.2461,-1.0334,.3974;-4.7365,-.6546,-.4229;-2.0744,.3322,-1.5639;-3.6021,.161,-2.3856;-5.6639,.9435,2.0518;-4.1959,.4331,2.8747;-4.6084,2.1424,2.7922;-5.4534,2.5377,-.6504;-4.3507,3.6977,.0729;-3.8891,2.8416,-1.3945;-3.4211,-2.3355,-2.1741;-2.1197,-1.6098,-3.1004;-1.4674,-.1936,1.888;-1.8106,3.6764,.0719;.8984,.2186,2.3054;.5372,4.0904,.4769;-.0088,-.8862,-1.6443;-2.841,-3.8678,-.4643;-1.179,-4.8255,1.1004;2.5004,4.3713,1.6036;2.7823,3.4844,.1008;4.9178,4.1414,1.16;4.5019,3.273,2.6334;4.7892,2.3849,1.129;2.1105,-2.5409,-2.547;3.2399,.3762,.3855;3.4306,-1.3449,-4.2369;4.5779,1.5659,-1.3136;4.6719,.7121,-3.6408; 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 3384 GEPOL Volume 2917.9997 GEPOL Surface-area 1653.6133 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 0.7s) Overall time for CPCM initialization 0.7s -1510.05447846 2966.28763281 -4476.34211127 -7963.54333965 3487.20122837 -0.02740491 -3013.97939142 1503.92491296 2.00407571 108.999824794870 108.999824794870 217.999649589740 -135.234714221440 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 -1800.5567 -674.8939 -524.7463 -524.1869 -281.9632 -281.6732 -281.5587 -281.3896 -280.8964 -279.9665 -279.8803 -279.8238 -279.8084 -279.7836 -279.7785 -279.7057 -279.7057 -279.7009 -279.6703 -279.6412 -279.5367 -279.5219 -279.3767 -279.3310 -279.1756 -279.1183 -278.7426 -278.6737 -278.6477 -145.6211 -100.6895 -100.6730 -100.6645 -36.7700 -33.0323 -32.3539 -27.0528 -26.6251 -26.4284 -24.9464 -24.2677 -24.1674 -23.6841 -23.5242 -23.4693 -23.0540 -22.7892 -22.0306 -21.3595 -21.3352 -20.7129 -20.4099 -19.9521 -19.6325 -19.3533 -19.0481 -18.6873 -18.4674 -17.9905 -17.5486 -17.5109 -16.7929 -16.3716 -16.1457 -16.1215 -15.9403 -15.6321 -15.6223 -15.3214 -14.8778 -14.7967 -14.7406 -14.6988 -14.4466 -14.3274 -14.2344 -14.0324 -13.9589 -13.8084 -13.6871 -13.6159 -13.4519 -13.3598 -13.3080 -13.1734 -12.9686 -12.9099 -12.8500 -12.7388 -12.5679 -12.4067 -12.2874 -12.2312 -12.1756 -12.0576 -11.6655 -11.4054 -11.3739 -11.2835 -11.1302 -10.4423 -10.3344 -9.9269 -9.6096 -9.4228 -9.3106 -8.9450 -8.3916 -8.3410 1.3219 1.5440 1.7050 1.8030 1.9623 2.1766 3.1033 3.3374 3.4735 3.7017 3.8011 4.0120 4.0908 4.2547 4.3848 4.5606 4.6399 4.7148 4.8849 4.9208 4.9978 5.0860 5.1584 5.1890 5.2783 5.4451 5.4765 5.5969 5.6866 5.7235 5.8265 5.9282 5.9680 6.0279 6.1500 6.1930 6.3725 6.4186 6.4362 6.5116 6.6031 6.7419 6.7797 6.9273 7.0002 7.0589 7.1046 7.2548 7.3742 7.4504 7.5619 7.6746 7.8167 7.8941 7.9403 7.9808 8.1309 8.2404 8.2841 8.3480 8.4094 8.5379 8.6431 8.8466 8.9355 8.9764 9.1171 9.2315 9.3026 9.3719 9.5217 9.6655 9.7506 9.7610 9.9352 10.1169 10.1902 10.2307 10.2587 10.3679 10.5544 10.6867 10.7257 10.7609 10.8259 10.9365 11.1025 11.1507 11.2918 11.4102 11.4371 11.5475 11.6117 11.6441 11.6818 11.7460 11.9332 12.0939 12.1337 12.1856 12.3539 12.4194 12.4691 12.6216 12.6958 12.7884 12.9897 13.0370 13.1386 13.1983 13.2724 13.2950 13.3845 13.4353 13.5863 13.6403 13.7097 13.7996 13.8661 13.9051 14.0772 14.0968 14.1428 14.1967 14.2856 14.3285 14.4086 14.4700 14.5445 14.6373 14.7012 14.7299 14.8047 14.8701 14.9146 15.0127 15.0716 15.2012 15.2365 15.3035 15.3838 15.5553 15.6054 15.6324 15.7263 15.7792 15.8907 15.9557 16.1096 16.1630 16.3462 16.3912 16.4863 16.5803 16.6872 16.7774 16.8403 16.9692 17.1330 17.2356 17.3909 17.3993 17.4147 17.5364 17.6927 17.9870 18.0482 18.1445 18.2332 18.3659 18.4767 18.6757 18.6925 18.8519 18.9942 19.0921 19.1681 19.4005 19.4176 19.6019 19.6890 19.7997 19.9101 20.0853 20.1535 20.2271 20.3103 20.4282 20.4493 20.6122 20.7219 20.8603 20.9294 21.0242 21.2560 21.3046 21.3671 21.4597 21.6109 21.6949 21.8664 21.8991 21.9853 21.9959 22.1580 22.3305 22.5161 22.5746 22.6300 22.7168 22.8248 23.1221 23.1518 23.3426 23.3952 23.4626 23.6397 23.6835 23.8235 24.0197 24.0836 24.1936 24.2622 24.4339 24.6825 24.7865 24.8705 25.0339 25.0806 25.2247 25.4235 25.4670 25.7870 25.8412 25.9558 25.9987 26.1822 26.3170 26.3789 26.4055 26.6092 26.6345 26.7216 26.7841 26.9430 27.0351 27.1094 27.3025 27.3725 27.4449 27.7418 27.8303 27.8997 28.0657 28.2147 28.3721 28.4391 28.5036 28.6482 28.7512 28.8181 28.9535 29.0832 29.2122 29.3559 29.3738 29.4553 29.6351 29.7751 29.8323 29.8887 30.0919 30.1385 30.1973 30.2777 30.3535 30.4485 30.5572 30.7242 30.8991 31.1040 31.1542 31.1986 31.2993 31.3313 31.5612 31.6693 31.7639 31.9215 32.1569 32.2489 32.3038 32.3743 32.4985 32.7186 32.8561 32.9569 32.9794 33.0467 33.2348 33.3446 33.4855 33.6338 33.6836 33.7387 33.8702 33.9909 34.0021 34.2154 34.3329 34.4637 34.6059 34.7083 34.8722 34.9591 35.0433 35.1767 35.2445 35.3271 35.3826 35.5156 35.6686 35.8563 36.0056 36.0973 36.2710 36.3887 36.5678 36.7688 36.8900 36.9334 37.0806 37.1720 37.3006 37.4240 37.5303 37.6842 37.8371 37.9357 38.0329 38.1360 38.2580 38.3557 38.4156 38.4873 38.7388 38.7724 38.8203 38.9400 39.0317 39.0756 39.2211 39.3885 39.4848 39.5658 39.7219 39.7394 39.8338 39.8450 40.1176 40.3362 40.3861 40.4731 40.5030 40.6860 40.8789 40.9378 40.9783 41.0897 41.1964 41.3974 41.4292 41.5506 41.5955 41.7082 41.8181 41.9927 42.0701 42.1705 42.4187 42.5049 42.5941 42.6774 42.7878 42.8876 43.0244 43.0846 43.1092 43.2396 43.4266 43.5628 43.6300 43.6978 43.8007 43.9585 44.0956 44.1884 44.2614 44.4961 44.5341 44.6040 44.7252 44.8020 44.8735 45.0208 45.0334 45.1366 45.2566 45.3755 45.4755 45.5381 45.7588 45.8878 45.9847 46.1768 46.2305 46.3228 46.3439 46.5624 46.6001 46.7340 46.8723 47.0147 47.1048 47.3255 47.4069 47.5890 47.7916 47.9493 48.1107 48.1967 48.2943 48.3707 48.6321 48.7269 48.8160 48.9120 49.1564 49.3669 49.4694 49.6720 49.7594 49.9832 50.2334 50.3133 50.3447 50.4565 50.7322 50.8445 51.1236 51.4824 51.6477 51.6727 51.8377 52.0423 52.1058 52.2830 52.4136 52.6225 52.9210 52.9927 53.1817 53.2263 53.4474 53.6573 53.7647 53.8515 54.1923 54.4185 54.4737 54.7276 54.7989 55.4059 55.7565 55.9939 56.0581 56.1512 56.5111 56.5908 56.8344 57.0566 57.3212 57.4967 57.5557 57.8290 57.9840 58.1009 58.2727 58.3710 58.4987 58.8578 59.0524 59.2783 59.4184 59.6840 59.7759 59.9234 59.9741 60.3690 60.4124 60.5989 60.6665 61.1665 61.3507 61.6518 61.7821 62.1436 62.1624 62.4189 62.6003 63.0206 63.2397 63.3532 63.5277 63.6991 63.8709 64.0778 64.5410 64.6068 64.7678 65.0126 65.2429 65.2756 65.5733 65.6770 65.7925 66.0394 66.3202 66.7876 67.0785 67.2791 67.4089 67.6568 67.9062 67.9807 68.0486 68.2934 68.3595 68.4807 68.8075 69.0449 69.1134 69.2668 69.6834 69.7882 70.2207 70.4670 70.6434 71.3230 71.5254 71.8202 72.0599 72.1227 72.3673 72.4143 72.6125 72.7594 72.8370 73.1554 73.5060 73.6543 73.7806 73.9073 74.1866 74.2315 74.3074 74.4048 74.7962 75.0189 75.1078 75.2727 75.4641 75.8439 75.9545 76.1411 76.3394 76.5160 76.5794 76.7435 76.8985 77.0909 77.2856 77.3891 77.4770 77.6550 77.7114 77.8800 77.9924 78.1372 78.2446 78.4434 78.5598 78.6886 78.8408 78.9835 79.1424 79.2776 79.3181 79.4083 79.5569 79.5925 79.6561 79.6914 79.8291 79.9653 80.0270 80.1515 80.2085 80.3003 80.3997 80.5887 80.6580 80.7647 80.8751 81.0947 81.2528 81.2760 81.4553 81.5826 81.6744 81.8857 81.9907 82.0729 82.1689 82.4186 82.4744 82.6376 82.7135 82.9091 82.9907 83.1072 83.1955 83.3497 83.4552 83.6228 83.7487 83.7913 83.9172 84.1021 84.1547 84.2639 84.4206 84.5976 84.6469 84.8153 84.8279 85.0367 85.1610 85.1928 85.3738 85.3968 85.4401 85.5249 85.6820 85.7482 85.8585 85.9678 86.0547 86.1380 86.1971 86.2370 86.4914 86.5204 86.6392 86.8228 86.8497 86.9224 87.0886 87.2850 87.3210 87.4872 87.5916 87.6835 87.7929 87.8331 87.9775 88.0599 88.1641 88.2303 88.5536 88.5602 88.6962 88.7762 88.8496 88.9345 89.0757 89.1367 89.3080 89.4066 89.4781 89.5668 89.6502 89.6906 89.8796 89.9187 90.1552 90.1891 90.2460 90.3249 90.4447 90.5340 90.6126 90.7315 90.8806 91.0208 91.1136 91.2810 91.3349 91.4254 91.4842 91.7248 91.7557 92.0183 92.1532 92.2818 92.4041 92.6513 92.7250 92.9247 93.0358 93.0678 93.1091 93.2952 93.3847 93.5322 93.5975 93.6703 93.7590 93.8728 93.9828 94.1186 94.3073 94.3165 94.4390 94.6255 94.6612 94.7637 94.9669 94.9990 95.1815 95.2293 95.2938 95.4490 95.5351 95.6296 95.7927 95.9240 95.9865 96.1596 96.1928 96.2921 96.5448 96.6295 96.7443 96.8237 97.0046 97.0550 97.1497 97.2251 97.3471 97.5003 97.7814 97.8790 98.0344 98.2001 98.2385 98.3176 98.3956 98.5548 98.7459 98.7507 98.8741 99.0763 99.1147 99.2007 99.2092 99.3675 99.5764 99.6825 99.7818 99.8234 99.9971 100.1807 100.2783 100.3483 100.4332 100.7480 100.8983 101.1273 101.1531 101.3804 101.5047 101.5784 101.6955 101.8282 101.9390 102.1504 102.2991 102.3769 102.4223 102.5979 102.7322 103.1435 103.3521 103.4269 103.6009 103.6277 103.8111 103.8721 103.9634 104.1768 104.2535 104.3785 104.6075 104.7160 104.8088 105.0866 105.3664 105.3753 105.5069 105.6542 105.7009 105.8249 105.8863 105.9511 106.0986 106.2579 106.3037 106.5094 106.5999 106.6602 106.9317 106.9408 107.0899 107.1735 107.3613 107.4889 107.6004 107.7605 107.9397 108.0057 108.1242 108.2383 108.3613 108.5177 108.6598 108.7447 108.8564 109.0200 109.2388 109.2684 109.4448 109.6554 109.7052 109.7925 109.9064 109.9947 110.1214 110.2547 110.5888 110.7054 110.7794 110.9307 111.1769 111.3529 111.4511 111.5585 111.6413 111.8370 112.0069 112.1279 112.2424 112.4731 112.5163 112.5628 112.7227 112.8407 113.0012 113.2526 113.3637 113.5074 113.6727 113.7604 113.8148 114.0290 114.0536 114.1805 114.4236 114.4851 114.7365 114.8865 114.8954 115.0222 115.1996 115.3446 115.4511 115.5620 115.7633 115.8118 115.8547 115.9686 116.0470 116.1850 116.3587 116.4687 116.5764 116.6915 116.7379 116.9714 117.1448 117.3222 117.4395 117.5056 117.5697 117.8015 117.8519 118.0686 118.1302 118.1959 118.3884 118.5078 118.6226 118.6860 118.7197 118.7684 118.8979 119.0757 119.1189 119.2468 119.4341 119.4629 119.5500 119.7437 119.8439 120.0548 120.1326 120.2843 120.3462 120.4214 120.6143 120.6774 120.7697 120.9140 121.2290 121.2972 121.4132 121.5215 121.6002 121.7336 121.8091 122.2516 122.4150 122.5457 122.8414 122.9900 123.1234 123.2963 123.5864 123.6529 123.8374 124.2003 124.3065 124.5654 124.9930 125.0442 125.2867 125.8400 126.1171 126.4324 126.4905 126.6202 126.7656 126.8094 127.0726 127.2154 127.2460 127.3631 127.6011 127.6955 127.8109 128.0089 128.3624 128.3735 128.4708 128.7874 128.8580 129.1702 129.3203 129.5465 129.6570 129.7303 129.9421 130.3240 130.5673 130.7338 130.8523 131.0891 131.2281 131.4155 131.6797 131.8223 131.9267 132.0462 132.1499 132.3172 132.4499 132.6295 132.7863 132.9323 133.4068 133.5144 133.9649 134.3292 134.3622 134.5213 134.7355 134.8685 135.2247 135.3672 135.6509 135.7657 135.9367 136.3073 136.4552 136.6589 136.7698 137.0296 137.2129 137.3026 137.5794 137.8337 138.0724 138.2833 138.4943 138.7546 138.8403 139.0475 139.0701 139.1314 139.6056 139.7176 140.0211 140.1961 140.3478 140.6544 141.1039 141.3100 141.7760 141.8635 142.0069 142.1232 142.7553 142.9497 143.0256 143.5098 143.5740 143.6741 143.7279 144.0308 144.1441 144.4019 144.4596 144.7836 144.9788 145.1179 145.2145 145.4810 146.0415 146.3167 146.3660 146.8177 147.1132 147.2079 147.5698 147.7764 147.9276 148.2306 148.3852 148.4002 148.6175 148.8218 148.8739 149.1262 149.2158 149.4530 149.6364 149.8437 149.9489 150.0645 150.2518 150.4389 150.6400 150.8131 151.0308 151.1769 151.4125 151.8391 151.9052 152.2842 152.4131 152.6977 152.8534 153.3480 153.7104 153.9450 153.9928 154.2112 154.3093 154.9715 155.5110 155.7155 156.0426 156.2457 156.3419 156.4098 156.6164 156.9214 157.0322 157.1101 157.2574 157.3481 157.8190 157.8913 158.0120 158.2214 158.6026 158.7734 159.3243 159.4272 159.6661 160.6858 161.2121 161.7877 162.0927 162.3834 163.0064 163.1866 164.5126 165.2390 168.2031 168.8459 169.5191 171.1595 171.8679 172.7120 173.8950 174.1737 176.2304 179.7127 180.5557 182.6841 186.4478 187.0477 187.7772 188.1315 189.0017 189.4364 189.4957 190.3717 190.5593 191.0886 192.2485 192.7232 192.9099 195.2748 196.0141 200.0278 202.1560 203.4906 206.0119 207.0756 208.1688 212.6397 229.8603 235.8940 241.0560 248.0021 248.9151 339.1408 618.7611 618.8242 621.1863 629.7641 630.3686 631.5945 632.4879 632.8825 634.3121 634.6077 635.3659 635.5739 637.1194 637.3482 637.5234 638.6985 639.8648 640.5034 642.7995 643.4160 645.9861 646.9396 654.1968 655.5874 658.1870 1214.3059 1216.5456 1563.3454 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 0.486957 -0.222071 -0.341123 -0.340581 -0.266040 -0.132967 -0.192370 -0.424565 -0.447660 -0.089352 -0.102239 -0.114640 0.003634 -0.312803 -0.255392 0.360994 -0.209156 -0.203101 0.217197 -0.155544 0.173049 0.034431 -0.280300 0.307139 -0.205634 -0.261880 -0.139673 -0.117593 -0.198881 0.074947 0.092992 0.075355 0.091608 0.103240 0.101563 0.101670 0.111000 0.105889 0.107999 0.082512 0.099940 0.135215 0.144400 0.136556 0.140305 0.148189 0.143698 0.150297 0.113148 0.103366 0.096388 0.094776 0.084519 0.157031 0.150123 0.162345 0.160393 0.160701 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 13.5130 9.2221 8.3411 8.3406 6.2660 6.1330 6.1924 6.4246 6.4477 6.0894 6.1022 6.1146 5.9964 6.3128 6.2554 5.6390 6.2092 6.2031 5.7828 6.1555 5.8270 5.9656 6.2803 5.6929 6.2056 6.2619 6.1397 6.1176 6.1989 0.9251 0.9070 0.9246 0.9084 0.8968 0.8984 0.8983 0.8890 0.8941 0.8920 0.9175 0.9001 0.8648 0.8556 0.8634 0.8597 0.8518 0.8563 0.8497 0.8869 0.8966 0.9036 0.9052 0.9155 0.8430 0.8499 0.8377 0.8396 0.8393 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 0.4870 -0.2221 -0.3411 -0.3406 -0.2660 -0.1330 -0.1924 -0.4246 -0.4477 -0.0894 -0.1022 -0.1146 0.0036 -0.3128 -0.2554 0.3610 -0.2092 -0.2031 0.2172 -0.1555 0.1730 0.0344 -0.2803 0.3071 -0.2056 -0.2619 -0.1397 -0.1176 -0.1989 0.0749 0.0930 0.0754 0.0916 0.1032 0.1016 0.1017 0.1110 0.1059 0.1080 0.0825 0.0999 0.1352 0.1444 0.1366 0.1403 0.1482 0.1437 0.1503 0.1131 0.1034 0.0964 0.0948 0.0845 0.1570 0.1501 0.1623 0.1604 0.1607 4.1280 1.0614 2.0451 2.0291 3.8429 3.8710 3.7399 3.8975 3.9189 3.8547 3.8098 3.8656 3.6772 3.9743 3.9360 3.6998 3.8509 3.8595 3.5908 3.8725 4.0671 3.7806 3.9655 3.7245 3.9290 3.9584 3.8806 3.8736 3.9393 1.0174 1.0155 1.0052 1.0074 1.0089 1.0090 1.0090 1.0083 1.0083 1.0054 1.0081 1.0039 0.9896 0.9880 1.0182 1.0099 1.0054 1.0022 0.9970 0.9896 0.9866 1.0047 1.0044 1.0005 0.9971 1.0242 0.9884 0.9859 0.9904 4.1280 1.0614 2.0451 2.0291 3.8429 3.8710 3.7399 3.8975 3.9189 3.8547 3.8098 3.8656 3.6772 3.9743 3.9360 3.6998 3.8509 3.8595 3.5908 3.8725 4.0671 3.7806 3.9655 3.7245 3.9290 3.9584 3.8806 3.8736 3.9393 1.0174 1.0155 1.0052 1.0074 1.0089 1.0090 1.0090 1.0083 1.0083 1.0054 1.0081 1.0039 0.9896 0.9880 1.0182 1.0099 1.0054 1.0022 0.9970 0.9896 0.9866 1.0047 1.0044 1.0005 0.9971 1.0242 0.9884 0.9859 0.9904 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 0.9527 1.0101 0.9634 0.9773 1.0604 1.0700 0.8642 0.9214 0.9370 0.9124 0.9844 0.9797 0.9223 1.0115 0.9935 1.2825 1.3392 0.9718 0.9754 0.9748 0.9714 0.9737 0.9739 0.9078 1.0140 1.0045 1.4533 0.9981 1.4514 0.9747 1.3566 1.3725 1.3056 1.0007 1.3312 0.9763 1.3369 0.9743 1.3803 0.9937 1.3641 1.4597 0.9870 0.9573 0.9751 0.9804 0.9923 0.9935 0.9958 1.3608 1.4007 1.4196 0.9756 1.4138 0.9568 1.4147 0.9767 1.4193 0.9754 0.9847 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 -0.033319685 -1510.087798147531 -15.71708 15.10362 -0.61347 24.59820 -23.37564 1.22256 -5.53041 3.97817 -1.55223 2.06892 5.25877