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:-4.0058,1.0387,.8405;2.0116,-1.7471,1.1299;1.9071,2.3599,.8052;1.5989,-.214,-1.1167;-4.1569,-.7093,.1451;-3.7017,-.8204,-1.318;-2.1723,1.4703,.8639;-4.6744,1.0903,2.5986;-4.9152,2.263,-.2593;-2.8806,-2.0804,-1.6162;-1.5899,2.3257,-.0773;-1.3163,.9119,1.8137;-1.5537,-2.0563,-.9102;-.2349,2.6083,-.0708;.0465,1.1825,1.8435;.598,2.0385,.8925;-.5426,-1.2077,-1.362;-1.3179,-2.8189,.2281;.661,-1.1105,-.6885;-.1152,-2.7272,.919;.8549,-1.8669,.461;2.8409,1.8202,1.7361;2.8435,2.556,3.0587;2.8472,-.6432,-1.4818;3.1374,-1.9616,-1.806;3.8314,.3362,-1.5489;4.433,-2.2958,-2.1802;5.1167,-.0134,-1.931;5.4279,-1.3312,-2.2425;-3.5481,-1.3519,.7911;-5.1801,-1.08,.253;-3.1001,.0443,-1.6205;-4.5755,-.8051,-1.9725;-4.5735,2.0836,3.0399;-5.7331,.8243,2.6272;-4.148,.3882,3.2486;-4.8036,3.2894,.095;-4.5577,2.2308,-1.2904;-5.9843,2.0412,-.2823;-3.4438,-2.9674,-1.3171;-2.7207,-2.1541,-2.6947;-2.2021,2.7887,-.8428;-1.708,.2389,2.5691;.1885,3.2716,-.8155;.6518,.7194,2.6109;-.6925,-.6021,-2.2485;-2.0835,-3.4924,.5918;.0609,-3.3116,1.8128;3.8116,1.9274,1.2521;2.6741,.7495,1.8756;3.0577,3.6157,2.9177;1.8984,2.4657,3.5939;3.6244,2.1413,3.697;2.374,-2.729,-1.78;3.5889,1.3628,-1.305;4.6586,-3.325,-2.4278;5.88,.7523,-1.98;6.434,-1.6014,-2.5336; 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 3041.4395134491 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 5.206e-06 Time for diagonalization 0.384 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.409 sec Total time needed 0.800 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:-4.0058,1.0387,.8405;2.0116,-1.7471,1.1299;1.9071,2.3599,.8052;1.5989,-.2141,-1.1167;-4.1569,-.7093,.1451;-3.7017,-.8204,-1.318;-2.1723,1.4703,.8639;-4.6744,1.0903,2.5986;-4.9152,2.263,-.2593;-2.8806,-2.0804,-1.6162;-1.5899,2.3257,-.0773;-1.3163,.9119,1.8137;-1.5537,-2.0563,-.9102;-.2349,2.6083,-.0708;.0465,1.1825,1.8435;.598,2.0385,.8925;-.5426,-1.2077,-1.362;-1.3179,-2.8189,.2281;.661,-1.1105,-.6885;-.1152,-2.7272,.919;.8549,-1.8669,.461;2.8409,1.8202,1.7361;2.8435,2.556,3.0587;2.8472,-.6432,-1.4818;3.1374,-1.9616,-1.806;3.8314,.3362,-1.5489;4.433,-2.2958,-2.1802;5.1167,-.0134,-1.931;5.4279,-1.3312,-2.2425;-3.5481,-1.3519,.7911;-5.1801,-1.08,.253;-3.1001,.0443,-1.6205;-4.5755,-.8051,-1.9725;-4.5735,2.0836,3.0399;-5.7331,.8243,2.6272;-4.148,.3882,3.2486;-4.8036,3.2894,.095;-4.5577,2.2308,-1.2904;-5.9843,2.0412,-.2823;-3.4438,-2.9674,-1.3171;-2.7207,-2.1541,-2.6947;-2.2021,2.7887,-.8428;-1.708,.2389,2.5691;.1885,3.2716,-.8154;.6518,.7194,2.6109;-.6925,-.6021,-2.2485;-2.0835,-3.4924,.5918;.0609,-3.3116,1.8128;3.8116,1.9274,1.2521;2.6741,.7495,1.8756;3.0577,3.6157,2.9177;1.8984,2.4657,3.5939;3.6244,2.1413,3.697;2.374,-2.729,-1.78;3.5889,1.3628,-1.305;4.6586,-3.325,-2.4278;5.88,.7523,-1.98;6.434,-1.6014,-2.5336; 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:-4.0058,1.0387,.8405;2.0116,-1.7471,1.1299;1.9071,2.3599,.8052;1.5989,-.214,-1.1167;-4.1569,-.7093,.1451;-3.7017,-.8204,-1.318;-2.1723,1.4703,.8639;-4.6744,1.0903,2.5986;-4.9152,2.263,-.2593;-2.8806,-2.0804,-1.6162;-1.5899,2.3257,-.0773;-1.3163,.9119,1.8137;-1.5537,-2.0563,-.9102;-.2349,2.6083,-.0708;.0465,1.1825,1.8435;.598,2.0385,.8925;-.5426,-1.2077,-1.362;-1.3179,-2.8189,.2281;.661,-1.1105,-.6885;-.1152,-2.7272,.919;.8549,-1.8669,.461;2.8409,1.8202,1.7361;2.8435,2.556,3.0587;2.8472,-.6432,-1.4818;3.1374,-1.9616,-1.806;3.8314,.3362,-1.5489;4.433,-2.2958,-2.1802;5.1167,-.0134,-1.931;5.4279,-1.3312,-2.2425;-3.5481,-1.3519,.7911;-5.1801,-1.08,.253;-3.1001,.0443,-1.6205;-4.5755,-.8051,-1.9725;-4.5735,2.0836,3.0399;-5.7331,.8243,2.6272;-4.148,.3882,3.2486;-4.8036,3.2894,.095;-4.5577,2.2308,-1.2904;-5.9843,2.0412,-.2823;-3.4438,-2.9674,-1.3171;-2.7207,-2.1541,-2.6947;-2.2021,2.7887,-.8428;-1.708,.2389,2.5691;.1885,3.2716,-.8155;.6518,.7194,2.6109;-.6925,-.6021,-2.2485;-2.0835,-3.4924,.5918;.0609,-3.3116,1.8128;3.8116,1.9274,1.2521;2.6741,.7495,1.8756;3.0577,3.6157,2.9177;1.8984,2.4657,3.5939;3.6244,2.1413,3.697;2.374,-2.729,-1.78;3.5889,1.3628,-1.305;4.6586,-3.325,-2.4278;5.88,.7523,-1.98;6.434,-1.6014,-2.5336; 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 3374 GEPOL Volume 2910.8675 GEPOL Surface-area 1610.5811 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 0.7s) Overall time for CPCM initialization 0.8s -1510.05199361 3041.43951345 -4551.49150706 -8114.60454963 3563.11304257 -0.02772309 -3013.96633727 1503.91434365 2.00408112 108.999520860337 108.999520860337 217.999041720674 -135.235245927614 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 -1800.5506 -674.9950 -524.7365 -524.1488 -282.0423 -281.6048 -281.5932 -281.3787 -280.8686 -279.9787 -279.8986 -279.8104 -279.8093 -279.7964 -279.7562 -279.7360 -279.6936 -279.6840 -279.6730 -279.5762 -279.5275 -279.4700 -279.3992 -279.3626 -279.1447 -279.0955 -278.7417 -278.6625 -278.6560 -145.6147 -100.6819 -100.6669 -100.6587 -36.8659 -33.0273 -32.2866 -27.0839 -26.5987 -26.3971 -24.9338 -24.2285 -24.1643 -23.6534 -23.4694 -23.4258 -23.0375 -22.8616 -22.0471 -21.3515 -21.3434 -20.5785 -20.4681 -20.0868 -19.6856 -19.4692 -19.1646 -18.6332 -18.4583 -18.0625 -17.3684 -17.2972 -16.8882 -16.4168 -16.1463 -16.0839 -15.9637 -15.7079 -15.3620 -15.0501 -14.9265 -14.7850 -14.7395 -14.6862 -14.5256 -14.2945 -14.2702 -14.2039 -14.0015 -13.9144 -13.8419 -13.7294 -13.4389 -13.3248 -13.2676 -13.0939 -12.9256 -12.8747 -12.7966 -12.7201 -12.6786 -12.5193 -12.3526 -12.2467 -11.9473 -11.7652 -11.7475 -11.4448 -11.3375 -11.2768 -11.1745 -10.4444 -10.3192 -9.8966 -9.4701 -9.4110 -9.3599 -8.9305 -8.5144 -8.2576 1.3748 1.6041 1.6701 1.8593 1.8953 2.1035 3.1238 3.5102 3.6508 3.7715 3.8672 3.9202 4.1417 4.2510 4.3111 4.4890 4.6561 4.8330 4.8618 4.8698 4.9498 5.1123 5.1540 5.2308 5.2961 5.4186 5.5568 5.5949 5.7370 5.7857 5.8741 5.9148 6.0179 6.1004 6.1721 6.1866 6.2615 6.3105 6.4206 6.4764 6.5122 6.6294 6.7802 6.8636 6.9311 7.0562 7.1644 7.3599 7.3803 7.4667 7.5478 7.7692 7.8860 7.9438 7.9671 8.0406 8.1104 8.1553 8.1915 8.2867 8.4157 8.6090 8.6745 8.7740 8.7875 9.0208 9.1221 9.1539 9.2756 9.4050 9.6589 9.6749 9.7460 9.7933 9.9633 10.0880 10.1878 10.3097 10.3441 10.4216 10.4843 10.6361 10.7257 10.8599 10.9331 10.9986 11.0723 11.1668 11.2012 11.4860 11.4904 11.5464 11.6518 11.6978 11.7843 11.9211 12.0436 12.1609 12.2574 12.3547 12.4275 12.4965 12.5636 12.6455 12.7865 12.8551 13.0168 13.0643 13.2497 13.2641 13.2991 13.3457 13.4770 13.5369 13.5533 13.6884 13.8086 13.8191 13.8840 13.9791 14.0557 14.1537 14.1849 14.2455 14.2848 14.3857 14.4836 14.5406 14.6264 14.6842 14.6871 14.7582 14.8764 14.9814 15.0500 15.1321 15.1947 15.2462 15.3129 15.4563 15.4884 15.5559 15.6528 15.7939 15.8596 15.9001 15.9480 16.0844 16.1991 16.2303 16.3969 16.4848 16.5841 16.6957 16.7514 16.8301 17.0066 17.0824 17.2426 17.3108 17.3803 17.4676 17.5099 17.7106 17.7289 17.9617 18.1462 18.1581 18.2948 18.4594 18.6827 18.7318 18.8681 18.9778 19.0098 19.0957 19.2990 19.3777 19.4623 19.5833 19.7525 19.8757 19.9606 20.1514 20.2249 20.2845 20.4623 20.6123 20.7408 20.7815 20.8933 20.9710 21.1330 21.2215 21.2570 21.3858 21.4272 21.5801 21.7306 21.8830 21.9250 22.0149 22.1526 22.2882 22.4325 22.5008 22.6364 22.6700 22.8925 22.9997 23.1329 23.1957 23.3497 23.4767 23.5757 23.7342 23.8488 24.0280 24.1423 24.1753 24.3811 24.4760 24.6282 24.7251 24.8479 24.9577 25.0642 25.1616 25.3731 25.5125 25.5930 25.8261 25.8956 25.9994 26.0928 26.1821 26.2391 26.4680 26.5480 26.7059 26.7790 26.8717 26.9567 27.1289 27.2405 27.3776 27.4267 27.6117 27.7294 27.7833 27.9283 28.0998 28.1919 28.3323 28.4609 28.5455 28.6847 28.7319 28.9855 29.1002 29.1790 29.3062 29.3494 29.3624 29.6019 29.6272 29.7117 29.8324 29.8939 30.0603 30.1501 30.2244 30.3786 30.5058 30.6375 30.7624 30.9276 30.9954 31.2047 31.2755 31.4031 31.4921 31.5855 31.7233 31.7559 31.7786 31.9887 32.1447 32.1516 32.3325 32.4913 32.6516 32.7335 32.7967 33.0133 33.1167 33.1636 33.2538 33.3937 33.5785 33.6503 33.7165 33.8063 33.9571 34.0019 34.0557 34.2786 34.3457 34.5267 34.7543 34.7886 34.9103 34.9760 35.1914 35.2660 35.3305 35.4803 35.6323 35.6654 35.7290 35.9474 36.0875 36.1667 36.2233 36.4537 36.5426 36.8502 36.8840 36.9179 37.1573 37.2193 37.2963 37.3847 37.4663 37.5923 37.6857 37.7078 37.9750 38.0601 38.1504 38.2633 38.4001 38.4669 38.5475 38.7491 38.8010 38.9141 38.9422 38.9972 39.2100 39.2957 39.3107 39.4222 39.6453 39.7626 39.9194 40.0048 40.0751 40.2315 40.3146 40.4596 40.5827 40.6936 40.7073 40.7808 40.9099 41.1307 41.2629 41.3887 41.5023 41.5420 41.6316 41.7822 41.8512 41.9929 42.0252 42.1119 42.3004 42.3592 42.4985 42.5995 42.6918 42.7475 42.8309 42.9242 42.9590 43.1823 43.2310 43.5307 43.5727 43.6351 43.7377 43.8025 43.9574 44.1145 44.1503 44.3223 44.3539 44.3942 44.6039 44.6707 44.8247 44.9754 45.1152 45.2100 45.2700 45.4465 45.5990 45.6293 45.7031 45.9022 45.9417 46.0182 46.2312 46.2695 46.4869 46.5044 46.7102 46.7932 46.8835 47.1037 47.2040 47.3827 47.4282 47.6075 47.6528 47.7765 47.9538 48.1996 48.2919 48.3109 48.5548 48.6551 48.7966 49.0292 49.1824 49.3905 49.5149 49.5963 49.7567 49.9887 50.1154 50.1785 50.3524 50.3979 50.6149 50.8023 51.1531 51.2830 51.3988 51.7352 51.9022 51.9642 52.0821 52.4071 52.5574 52.7695 52.8834 52.9562 53.1229 53.3053 53.4540 53.5962 53.9927 54.1391 54.2273 54.5227 54.6268 54.6934 54.9682 55.1326 55.5563 55.7285 55.8710 55.9485 56.2342 56.2525 56.5646 56.6229 56.9844 57.0435 57.2889 57.5600 57.6251 57.7974 57.8422 58.0337 58.4293 58.6642 58.9590 59.1037 59.3475 59.4903 59.6448 59.8655 59.9423 60.1037 60.3409 60.5984 60.8801 61.1503 61.3827 61.4108 61.6899 61.9104 62.0695 62.3087 62.3629 63.0065 63.1217 63.2271 63.4930 63.7710 63.9719 64.0812 64.2128 64.5331 64.6498 64.8066 65.0792 65.2358 65.3331 65.5798 66.0413 66.1845 66.4133 66.4302 66.6891 66.8787 66.9246 67.2689 67.4371 67.5353 67.8113 67.9502 68.0373 68.1615 68.5253 68.7305 68.9440 69.0426 69.3919 69.5638 70.1448 70.3148 70.4515 70.5643 70.8928 71.1631 71.3955 71.6581 71.7857 72.1187 72.2848 72.5665 72.8841 73.0248 73.1221 73.2427 73.2768 73.5379 73.9853 74.2065 74.2582 74.4162 74.5932 74.7124 74.9120 75.0277 75.1335 75.4387 75.6137 75.7323 76.0286 76.1581 76.3001 76.5287 76.6605 76.7764 76.8607 76.8663 77.0414 77.3526 77.5720 77.6973 77.7538 78.0196 78.1599 78.2865 78.3262 78.4613 78.6111 78.6940 78.7186 79.0498 79.1330 79.2259 79.3450 79.4120 79.4503 79.5781 79.6323 79.7217 79.9382 80.0713 80.0929 80.4321 80.5141 80.5641 80.5963 80.7142 80.7742 80.8536 81.0050 81.2278 81.3238 81.4079 81.4949 81.6077 81.8091 82.0233 82.0616 82.3619 82.4473 82.5443 82.7523 82.8334 83.0414 83.1319 83.2627 83.4832 83.6100 83.6960 83.7886 83.8887 83.9467 84.0860 84.2710 84.4528 84.5763 84.7079 84.7553 84.8774 84.9680 85.0872 85.1943 85.2605 85.3107 85.3810 85.5269 85.6509 85.7294 85.7699 85.8471 85.9504 85.9565 86.1798 86.2277 86.2526 86.5601 86.5901 86.6296 86.9360 86.9928 87.0515 87.1353 87.2951 87.4514 87.4746 87.6445 87.7497 87.8573 87.9367 88.0555 88.1330 88.2677 88.3580 88.4328 88.5022 88.5618 88.7725 88.8997 88.9179 89.0101 89.2736 89.2836 89.3986 89.4095 89.5677 89.6070 89.7742 89.8922 89.9640 90.0235 90.1342 90.2838 90.3530 90.4281 90.5484 90.6995 90.9280 90.9778 91.1454 91.1746 91.2439 91.3119 91.4544 91.5402 91.7200 91.7694 91.9784 92.0506 92.5068 92.6402 92.6752 92.7095 92.9103 92.9660 93.0719 93.1501 93.3039 93.4218 93.4510 93.6131 93.6350 93.7120 93.8243 93.9418 94.0252 94.1949 94.2578 94.4564 94.4828 94.5607 94.8205 94.9107 95.0199 95.1421 95.2079 95.3755 95.5315 95.5802 95.6195 95.7827 95.8411 95.9326 95.9815 96.1614 96.2707 96.5743 96.5984 96.7661 96.8740 97.0481 97.1003 97.1839 97.4597 97.5513 97.6315 97.7891 97.8380 97.9512 98.0220 98.1138 98.2283 98.3906 98.4714 98.6991 98.7267 98.9018 98.9770 99.0211 99.2201 99.2587 99.4416 99.5139 99.6230 99.7613 99.8945 100.0304 100.1328 100.2074 100.2907 100.3186 100.5135 100.5995 100.6459 100.7379 100.9734 101.1933 101.2424 101.4256 101.5812 101.7277 101.7888 101.9147 102.1455 102.3053 102.3830 102.6998 102.8319 103.0554 103.0647 103.1715 103.3013 103.4214 103.5784 103.7334 103.9503 104.0982 104.2198 104.3675 104.6506 104.8321 104.9105 105.0497 105.1315 105.1611 105.3472 105.5072 105.5860 105.7369 105.7896 105.9016 105.9974 106.1202 106.2840 106.3544 106.4149 106.5662 106.8346 106.9724 107.0492 107.1038 107.2711 107.3340 107.5493 107.7432 107.8274 107.9327 107.9939 108.1319 108.1879 108.4933 108.5731 108.7101 108.8842 109.1011 109.1440 109.2769 109.3733 109.4721 109.6736 109.7408 109.8613 110.1138 110.2033 110.3617 110.4277 110.6085 110.7589 110.9078 111.0075 111.1675 111.3559 111.4614 111.6254 111.7708 111.9020 112.0486 112.1285 112.2950 112.3206 112.4781 112.5955 112.7499 112.9646 113.2513 113.3688 113.5379 113.7675 113.8936 113.9814 114.1213 114.2953 114.4250 114.5867 114.6151 114.7582 114.7883 114.8935 115.1133 115.1890 115.2615 115.3269 115.5793 115.6774 115.7872 115.8856 116.1138 116.1392 116.2836 116.3777 116.4041 116.5330 116.7461 116.8490 117.0450 117.1679 117.3601 117.5674 117.6098 117.7277 117.8411 118.0938 118.1674 118.2444 118.3212 118.3795 118.4385 118.5866 118.6208 118.7959 118.8719 118.9396 119.0082 119.0873 119.2007 119.3761 119.4551 119.5939 119.7742 119.8849 120.0302 120.1004 120.2183 120.3268 120.4356 120.5405 120.6766 120.7623 120.9311 121.0033 121.2128 121.3753 121.4784 121.7559 121.8969 122.0480 122.1680 122.2189 122.4037 122.6185 122.7720 123.0316 123.1238 123.4717 123.6630 123.7447 123.9278 124.1164 124.3544 124.5928 124.7593 125.2016 125.3025 125.7061 126.0949 126.3044 126.4095 126.7492 126.8303 126.9433 126.9581 127.1296 127.2705 127.4363 127.5543 127.6594 127.9116 128.1888 128.2995 128.5550 128.6180 128.8617 129.0372 129.3681 129.5381 129.6344 129.8106 129.9196 129.9798 130.0111 130.4886 130.6490 130.9526 131.1150 131.2589 131.4644 131.6259 131.7606 131.8303 132.0861 132.2009 132.2269 132.5348 132.6482 132.8262 132.9911 133.0147 133.3005 133.4896 133.6898 134.1524 134.5563 134.8993 135.0298 135.2795 135.3613 135.6154 135.7982 135.8754 136.1992 136.3506 136.6123 136.7208 136.9661 137.1577 137.5311 137.7939 137.9926 138.1550 138.2807 138.4818 138.7110 138.8267 138.9736 139.3959 139.5218 139.6826 139.8891 140.2700 140.3888 140.5204 140.7273 141.1820 141.4749 141.5851 141.7453 141.9792 142.2806 142.7217 143.0142 143.2358 143.3567 143.6076 143.8049 143.8947 144.0795 144.1871 144.2212 144.4237 144.4992 144.6359 144.8747 145.0472 145.1080 145.7422 146.0069 146.5233 146.7855 146.8467 147.4859 147.7376 147.8873 148.0948 148.1277 148.2455 148.5562 148.5936 148.7952 148.9078 149.1719 149.1785 149.5585 149.6696 149.7844 149.8284 150.0684 150.2570 150.5385 150.6806 150.9320 151.0643 151.3058 151.4633 151.7451 151.7816 151.9854 152.3054 153.0196 153.0953 153.2480 153.3049 153.6465 153.8920 154.1805 154.3697 154.5446 155.4019 155.5631 155.7541 156.2528 156.2902 156.5403 156.8435 156.9221 157.0668 157.2276 157.4263 157.4826 157.5631 157.9398 158.0165 158.5814 158.9299 159.2025 159.3634 159.5231 159.9310 160.5468 161.3277 161.4070 161.8912 163.0722 163.5075 164.1712 164.3883 165.2641 168.0346 168.5798 169.5522 170.9773 171.2867 171.7201 174.3552 175.1108 177.2382 180.4427 181.1585 183.2524 186.7472 186.9861 187.7680 188.7684 189.0747 189.3337 189.6865 190.4336 190.8037 191.7426 192.3753 192.8362 193.9710 195.4642 196.3891 200.0289 202.3024 202.7331 206.3058 207.8332 208.6975 212.4445 230.5041 236.3515 241.6506 249.0134 249.2758 339.0376 619.8620 620.0909 625.4918 630.0150 630.9157 631.9741 632.6526 633.0370 634.3252 634.9457 635.3443 635.6097 637.0182 637.2399 638.0307 638.3540 640.0604 640.2910 643.1399 643.6236 645.6589 646.5502 654.2067 655.9675 658.0960 1213.9816 1218.5405 1568.7797 -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 0.487355 -0.225374 -0.354291 -0.328564 -0.275989 -0.121966 -0.116508 -0.448548 -0.432056 -0.097031 -0.120138 -0.253950 0.076571 -0.269357 -0.160217 0.312005 -0.283084 -0.197799 0.184513 -0.146789 0.243939 0.055528 -0.268110 0.321815 -0.202470 -0.288199 -0.162551 -0.123937 -0.192408 0.078948 0.097066 0.064484 0.095151 0.103429 0.103514 0.100827 0.109833 0.101366 0.108933 0.088361 0.096077 0.144770 0.135728 0.134485 0.140703 0.133516 0.147846 0.148126 0.104935 0.082808 0.089189 0.092007 0.096212 0.154681 0.153288 0.161106 0.160272 0.159951 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 13.5126 9.2254 8.3543 8.3286 6.2760 6.1220 6.1165 6.4485 6.4321 6.0970 6.1201 6.2540 5.9234 6.2694 6.1602 5.6880 6.2831 6.1978 5.8155 6.1468 5.7561 5.9445 6.2681 5.6782 6.2025 6.2882 6.1626 6.1239 6.1924 0.9211 0.9029 0.9355 0.9048 0.8966 0.8965 0.8992 0.8902 0.8986 0.8911 0.9116 0.9039 0.8552 0.8643 0.8655 0.8593 0.8665 0.8522 0.8519 0.8951 0.9172 0.9108 0.9080 0.9038 0.8453 0.8467 0.8389 0.8397 0.8400 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 0.4874 -0.2254 -0.3543 -0.3286 -0.2760 -0.1220 -0.1165 -0.4485 -0.4321 -0.0970 -0.1201 -0.2540 0.0766 -0.2694 -0.1602 0.3120 -0.2831 -0.1978 0.1845 -0.1468 0.2439 0.0555 -0.2681 0.3218 -0.2025 -0.2882 -0.1626 -0.1239 -0.1924 0.0789 0.0971 0.0645 0.0952 0.1034 0.1035 0.1008 0.1098 0.1014 0.1089 0.0884 0.0961 0.1448 0.1357 0.1345 0.1407 0.1335 0.1478 0.1481 0.1049 0.0828 0.0892 0.0920 0.0962 0.1547 0.1533 0.1611 0.1603 0.1600 4.1344 1.0495 2.0220 2.0095 3.8313 3.8713 3.6535 3.9053 3.9083 3.8565 3.8411 3.9379 3.5575 4.0264 3.7773 3.6672 4.0021 3.8921 3.5545 3.9269 3.8884 3.8125 3.9624 3.6638 3.9014 3.9604 3.9108 3.9058 3.9067 1.0169 1.0112 1.0068 1.0082 1.0093 1.0106 1.0109 1.0070 1.0083 1.0088 1.0064 1.0065 0.9859 0.9958 1.0130 1.0032 1.0194 0.9997 0.9998 0.9894 1.0059 1.0050 1.0020 1.0067 1.0019 1.0142 0.9898 0.9902 0.9895 4.1344 1.0495 2.0220 2.0095 3.8313 3.8713 3.6535 3.9053 3.9083 3.8565 3.8411 3.9379 3.5575 4.0264 3.7773 3.6672 4.0021 3.8921 3.5545 3.9269 3.8884 3.8125 3.9624 3.6638 3.9014 3.9604 3.9108 3.9058 3.9067 1.0169 1.0112 1.0068 1.0082 1.0093 1.0106 1.0109 1.0070 1.0083 1.0088 1.0064 1.0065 0.9859 0.9958 1.0130 1.0032 1.0194 0.9997 0.9998 0.9894 1.0059 1.0050 1.0020 1.0067 1.0019 1.0142 0.9898 0.9902 0.9895 -0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 0.9482 0.9942 0.9623 0.9782 0.9736 1.0375 0.8696 0.8334 0.9934 0.9044 0.9849 0.9768 0.9225 1.0153 0.9962 1.2780 1.3484 0.9727 0.9763 0.9788 0.9738 0.9721 0.9737 0.9074 1.0129 1.0079 1.4879 0.9936 1.4033 0.9879 1.3423 1.3334 1.3304 1.0046 1.2629 1.0020 1.4020 1.0058 1.4104 0.9987 1.2964 1.4578 0.9888 0.9646 0.9760 0.9812 0.9926 0.9923 0.9878 1.3442 1.3375 1.4173 0.9713 1.4555 0.9751 1.4272 0.9783 1.3989 0.9796 0.9848 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 -0.036117178 -1510.088110791560 -20.69062 20.15068 -0.53993 8.55368 -9.60269 -1.04901 5.45751 -5.19920 0.25831 1.20776 3.06988