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:-3.4345,1.4376,-.3168;2.4117,-2.533,.6667;1.9354,2.6389,2.2272;1.5703,-2.2089,-1.9119;-3.3505,-.3052,-1.0547;-3.7351,-1.4502,-.1115;-1.7757,1.8015,.505;-4.8194,1.5561,.9553;-3.7291,2.6912,-1.6885;-3.0863,-2.7927,-.4765;-1.1507,.8629,1.3282;-1.0896,3.0032,.3;-1.61,-2.7836,-.1939;.0865,1.0879,1.9193;.1403,3.2545,.8827;.7439,2.297,1.7002;-.6808,-2.5123,-1.195;-1.147,-2.9658,1.1076;.6718,-2.4232,-.9072;.2041,-2.8817,1.4102;1.1001,-2.612,.3985;2.6254,1.7439,3.0915;3.4067,.685,2.3459;2.3282,-1.0673,-1.8849;1.8868,.1152,-1.3055;3.5679,-1.1336,-2.5076;2.7116,1.2327,-1.3415;4.3757,-.0077,-2.54;3.9562,1.1788,-1.9519;-3.9754,-.3529,-1.9524;-2.3237,-.4303,-1.415;-4.8215,-1.5677,-.1169;-3.4748,-1.2254,.9273;-4.8913,2.5658,1.3657;-5.7904,1.3134,.5169;-4.6617,.8775,1.7963;-2.9519,2.6519,-2.4548;-4.682,2.4938,-2.1853;-3.7718,3.7163,-1.3147;-3.5605,-3.5881,.104;-3.2699,-3.0177,-1.5301;-1.625,-.092,1.5251;-1.5174,3.7742,-.3307;.5156,.3104,2.5372;.6454,4.1971,.7071;-1.0038,-2.3713,-2.2199;-1.8504,-3.1784,1.9035;.5608,-3.0338,2.421;1.9385,1.2946,3.8149;3.3097,2.3763,3.6581;2.7692,.0008,1.7869;4.1163,1.1359,1.6513;3.9761,.091,3.0625;.9144,.1811,-.8321;3.896,-2.0623,-2.9577;2.3694,2.1534,-.8864;5.3438,-.0639,-3.0211;4.5925,2.0537,-1.9721; 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 3025.9749394041 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 5.396e-06 Time for diagonalization 0.516 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.527 sec Total time needed 1.059 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:-3.4345,1.4376,-.3168;2.4117,-2.533,.6667;1.9354,2.6389,2.2272;1.5703,-2.2089,-1.9119;-3.3505,-.3052,-1.0547;-3.7351,-1.4502,-.1115;-1.7757,1.8015,.505;-4.8194,1.5561,.9553;-3.7291,2.6912,-1.6885;-3.0863,-2.7927,-.4765;-1.1507,.8629,1.3282;-1.0896,3.0032,.3;-1.61,-2.7836,-.1939;.0865,1.0879,1.9193;.1403,3.2545,.8827;.7439,2.297,1.7002;-.6808,-2.5123,-1.195;-1.147,-2.9658,1.1076;.6718,-2.4232,-.9072;.2041,-2.8817,1.4102;1.1001,-2.612,.3985;2.6254,1.7439,3.0915;3.4067,.685,2.3459;2.3282,-1.0673,-1.8849;1.8868,.1152,-1.3055;3.5679,-1.1336,-2.5076;2.7116,1.2327,-1.3415;4.3757,-.0077,-2.54;3.9562,1.1788,-1.9519;-3.9754,-.3529,-1.9524;-2.3237,-.4303,-1.415;-4.8215,-1.5677,-.1169;-3.4748,-1.2254,.9273;-4.8913,2.5658,1.3657;-5.7904,1.3134,.5169;-4.6617,.8775,1.7963;-2.9519,2.6519,-2.4548;-4.682,2.4938,-2.1853;-3.7718,3.7163,-1.3147;-3.5605,-3.5881,.104;-3.2699,-3.0177,-1.5301;-1.625,-.092,1.5251;-1.5174,3.7742,-.3307;.5156,.3104,2.5372;.6454,4.1971,.7071;-1.0038,-2.3713,-2.2199;-1.8504,-3.1784,1.9035;.5608,-3.0338,2.421;1.9385,1.2946,3.8149;3.3097,2.3763,3.6581;2.7692,.0008,1.7869;4.1163,1.1359,1.6513;3.9761,.091,3.0625;.9144,.1811,-.8321;3.896,-2.0623,-2.9577;2.3694,2.1534,-.8864;5.3438,-.0639,-3.0211;4.5925,2.0537,-1.9721; 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 "1-OCTANOL" 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:-3.4345,1.4376,-.3168;2.4117,-2.533,.6667;1.9354,2.6389,2.2272;1.5703,-2.2089,-1.9119;-3.3505,-.3052,-1.0547;-3.7351,-1.4502,-.1115;-1.7757,1.8015,.505;-4.8194,1.5561,.9553;-3.7291,2.6912,-1.6885;-3.0863,-2.7927,-.4765;-1.1507,.8629,1.3282;-1.0896,3.0032,.3;-1.61,-2.7836,-.1939;.0865,1.0879,1.9193;.1403,3.2545,.8827;.7439,2.297,1.7002;-.6808,-2.5123,-1.195;-1.147,-2.9658,1.1076;.6718,-2.4232,-.9072;.2041,-2.8817,1.4102;1.1001,-2.612,.3985;2.6254,1.7439,3.0915;3.4067,.685,2.3459;2.3282,-1.0673,-1.8849;1.8868,.1152,-1.3055;3.5679,-1.1336,-2.5076;2.7116,1.2327,-1.3415;4.3757,-.0077,-2.54;3.9562,1.1788,-1.9519;-3.9754,-.3529,-1.9524;-2.3237,-.4303,-1.415;-4.8215,-1.5677,-.1169;-3.4748,-1.2254,.9273;-4.8913,2.5658,1.3657;-5.7904,1.3134,.5169;-4.6617,.8775,1.7963;-2.9519,2.6519,-2.4548;-4.682,2.4938,-2.1853;-3.7718,3.7163,-1.3147;-3.5605,-3.5881,.104;-3.2699,-3.0177,-1.5301;-1.625,-.092,1.5251;-1.5174,3.7742,-.3307;.5156,.3104,2.5372;.6454,4.1971,.7071;-1.0038,-2.3713,-2.2199;-1.8504,-3.1784,1.9035;.5608,-3.0338,2.421;1.9385,1.2946,3.8149;3.3097,2.3763,3.6581;2.7692,.0008,1.7869;4.1163,1.1359,1.6513;3.9761,.091,3.0625;.9144,.1811,-.8321;3.896,-2.0623,-2.9577;2.3694,2.1534,-.8864;5.3438,-.0639,-3.0211;4.5925,2.0537,-1.9721; Epsilon 9.8629 Refrac 1.4295 Rsolv 1.3000 Surface type GAUSSIAN VDW Epsilon function type CPCM Si F O C H 2.4700 1.7300 1.6280 1.8500 1.2000 Solvent: 1-OCTANOL Soln 1.4295 Soln25 1.4279 Sola 0.3700 Solb 0.4800 Solg 39.0100 Solc 0.0000 Solh 0.0000 Calculating surface done! ( 0.0s) GEPOL surface points 3377 GEPOL Volume 2926.8477 GEPOL Surface-area 1636.2432 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 0.9s) Overall time for CPCM initialization 1.0s -1510.06636266 3025.97493940 -4536.04130206 -8082.28961471 3546.24831265 -0.02248876 -3013.96507695 1503.89871429 2.00410111 108.999988138655 108.999988138655 217.999976277309 -135.230036811359 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 -1800.6178 -674.9740 -524.6556 -524.1359 -282.0476 -281.5747 -281.5455 -281.3939 -280.9066 -280.0085 -279.9405 -279.8364 -279.7838 -279.7816 -279.7763 -279.7028 -279.6971 -279.6844 -279.6688 -279.5665 -279.5410 -279.4767 -279.4452 -279.4174 -279.1505 -279.1215 -278.7980 -278.6870 -278.6795 -145.6739 -100.7397 -100.7250 -100.7219 -36.8497 -32.9886 -32.3178 -27.0793 -26.5809 -26.4020 -24.9600 -24.2009 -24.1865 -23.6233 -23.4984 -23.4429 -23.0429 -22.8572 -22.0684 -21.3885 -21.3427 -20.5518 -20.4888 -19.9926 -19.6809 -19.4774 -19.2966 -18.6493 -18.4330 -18.0558 -17.3524 -17.3303 -16.8438 -16.4133 -16.1592 -16.0724 -15.9630 -15.6525 -15.5118 -15.0882 -14.9602 -14.8919 -14.6917 -14.6476 -14.5198 -14.3507 -14.2462 -14.1092 -14.0735 -13.8921 -13.7937 -13.6096 -13.4191 -13.3646 -13.3155 -13.2011 -12.9970 -12.8489 -12.7739 -12.7214 -12.6349 -12.5529 -12.3252 -12.2495 -11.9572 -11.8090 -11.7559 -11.5104 -11.4185 -11.2049 -11.1436 -10.4668 -10.2881 -9.9519 -9.4636 -9.4267 -9.2721 -8.9911 -8.5147 -8.2630 1.3714 1.5670 1.6556 1.8704 1.9077 2.0580 3.0904 3.4245 3.4862 3.7504 3.8449 3.9704 4.0811 4.2179 4.3110 4.4235 4.5112 4.6800 4.8069 4.9488 5.0406 5.0842 5.1624 5.1978 5.3514 5.3847 5.5010 5.6348 5.6585 5.6825 5.7515 5.8907 6.0040 6.0598 6.1043 6.1584 6.3153 6.3810 6.5180 6.5465 6.6396 6.6974 6.7591 6.8508 6.9264 7.1221 7.1328 7.2492 7.4284 7.5459 7.6650 7.7482 7.9239 7.9329 8.0784 8.1214 8.2250 8.2824 8.2888 8.4713 8.4912 8.6321 8.7418 8.8370 8.8860 8.9507 9.1197 9.2123 9.3249 9.4868 9.5926 9.6491 9.6948 9.8282 10.0129 10.1236 10.1407 10.2602 10.3336 10.4566 10.6063 10.7247 10.8611 10.9469 11.0004 11.1006 11.1540 11.2557 11.3696 11.4732 11.5797 11.6494 11.6843 11.8285 11.9642 12.1023 12.1145 12.1431 12.2672 12.4130 12.4636 12.5553 12.5864 12.6597 12.8304 12.8727 12.9744 12.9883 13.0929 13.2962 13.3519 13.3688 13.5303 13.6460 13.6901 13.7780 13.8120 13.8619 13.9162 14.0121 14.1355 14.1671 14.1726 14.2190 14.2984 14.3285 14.4045 14.5904 14.7007 14.7366 14.7929 14.7994 14.9463 15.0298 15.0747 15.2282 15.2706 15.3123 15.3975 15.5725 15.6079 15.7384 15.8036 15.8604 15.8779 15.9501 16.0147 16.0443 16.1632 16.2436 16.3141 16.4280 16.4913 16.5653 16.7878 16.9976 17.0082 17.1006 17.1757 17.3053 17.3470 17.5822 17.6521 17.7669 17.8846 17.9720 18.0434 18.1150 18.3106 18.4218 18.5730 18.6631 19.0769 19.1436 19.2967 19.3574 19.4599 19.6338 19.7984 19.8577 19.9134 19.9942 20.1556 20.2806 20.4021 20.4580 20.5517 20.5805 20.6353 20.8747 20.9564 21.1351 21.1526 21.3010 21.3995 21.4673 21.6388 21.6595 21.7822 21.9224 21.9757 22.1857 22.2234 22.3615 22.5164 22.5309 22.6387 22.7812 22.8195 23.0195 23.1393 23.2458 23.4187 23.5810 23.6487 23.7740 23.7992 23.8649 24.1623 24.2680 24.3490 24.3826 24.5433 24.6035 24.8030 24.8918 24.9511 25.1153 25.3720 25.3820 25.4584 25.5015 25.6108 25.8045 25.8599 26.0216 26.0995 26.2264 26.3475 26.5484 26.6934 26.8396 26.9353 27.0540 27.1365 27.2024 27.4485 27.5048 27.5733 27.6947 27.7733 27.9487 28.0619 28.2075 28.2299 28.4699 28.5247 28.6970 28.7302 28.8418 29.0645 29.1180 29.1756 29.1795 29.3668 29.5397 29.7415 29.7699 29.9004 30.0056 30.0573 30.2195 30.3511 30.3815 30.7124 30.7344 30.9121 31.0146 31.1971 31.2962 31.3479 31.4478 31.5021 31.6210 31.7106 31.8208 31.8952 32.0424 32.1282 32.2287 32.3288 32.3898 32.5106 32.7118 32.7971 32.8453 32.9498 33.0653 33.1471 33.2987 33.4770 33.5652 33.6164 33.7452 33.8640 34.0881 34.1213 34.3133 34.3810 34.5894 34.6841 34.8235 34.9683 35.1444 35.2009 35.3333 35.3445 35.4910 35.6444 35.7048 35.8255 35.9078 36.0038 36.0859 36.3453 36.5311 36.6421 36.7979 36.8850 36.9441 37.0493 37.2833 37.4069 37.5050 37.5705 37.6438 37.7692 37.8960 38.0089 38.0820 38.1751 38.2747 38.3098 38.5847 38.6533 38.8790 38.9072 38.9560 39.0022 39.1393 39.1913 39.3898 39.5031 39.6147 39.6666 39.7473 39.8454 40.0658 40.1254 40.1726 40.2962 40.5288 40.6454 40.6897 40.8027 40.8697 41.0230 41.1525 41.2134 41.3458 41.4580 41.4677 41.5449 41.6765 41.7973 41.9170 42.1861 42.2708 42.3409 42.4234 42.6525 42.7399 42.7702 43.0096 43.0485 43.2476 43.2827 43.3457 43.4249 43.5457 43.6536 43.7617 43.9051 44.0242 44.1854 44.2349 44.3153 44.3967 44.5498 44.6733 44.7874 44.9997 45.1253 45.2048 45.2916 45.4053 45.5008 45.5841 45.6309 45.8036 45.9609 46.0737 46.1539 46.2405 46.4082 46.5880 46.6587 46.9110 46.9995 47.1010 47.1758 47.2567 47.4861 47.5979 47.8231 47.8928 47.9607 48.1584 48.2951 48.3381 48.3837 48.5282 48.7262 48.9493 49.1145 49.1666 49.3279 49.3847 49.5454 49.6565 49.8596 50.0486 50.2025 50.3030 50.4757 50.6797 50.8652 51.0925 51.1490 51.4851 51.7274 51.9028 52.0540 52.1622 52.3192 52.5277 52.6092 52.7694 52.9478 53.1354 53.2554 53.3354 53.4158 53.5674 54.0190 54.1501 54.3777 54.6735 54.9101 55.0746 55.2484 55.4335 55.7667 55.8916 55.9727 56.2276 56.2607 56.4826 56.5186 56.9934 57.1157 57.2756 57.4895 57.7173 57.7882 58.0586 58.1403 58.3657 58.5134 58.7132 58.9647 59.0664 59.2562 59.3615 59.5769 59.7768 60.0182 60.2960 60.4132 60.5283 60.8766 60.8794 61.2695 61.4415 61.6011 61.6840 62.2937 62.3811 62.5647 62.7839 63.0103 63.4751 63.5226 63.7708 63.9831 64.1873 64.4043 64.4844 64.6826 64.8650 65.0136 65.2027 65.3690 65.5927 65.7351 66.0782 66.1442 66.2057 66.4218 66.8726 67.0316 67.2825 67.4964 67.6098 68.0087 68.2237 68.2647 68.4649 68.6375 68.8280 68.9756 69.3482 69.4965 69.6696 69.9188 70.2429 70.5736 70.7274 71.0524 71.3357 71.3924 71.6128 72.1365 72.3161 72.6212 72.7483 72.8478 72.9959 73.4338 73.5250 73.7414 74.0693 74.1494 74.2895 74.4267 74.4750 74.7011 74.9891 75.1148 75.2845 75.5840 75.6798 75.8557 76.0147 76.2870 76.3943 76.4239 76.5874 76.8737 76.9785 77.0956 77.2108 77.3304 77.4729 77.6110 77.8019 78.0743 78.1535 78.3759 78.4320 78.4391 78.6349 78.7432 78.8311 78.8787 79.0144 79.0831 79.2172 79.4589 79.5088 79.5432 79.5952 79.8342 79.8803 80.0985 80.2283 80.3357 80.4364 80.5201 80.5611 80.8577 80.8650 80.9557 81.1506 81.2150 81.2951 81.3667 81.6426 81.6488 81.7643 81.9019 81.9683 82.1026 82.2761 82.3750 82.5493 82.7490 82.9386 83.0258 83.1830 83.2402 83.3505 83.6162 83.6603 83.7687 83.8865 83.9844 84.1012 84.1715 84.2888 84.5148 84.5801 84.6859 84.8658 84.9095 85.0217 85.1310 85.1626 85.3232 85.4801 85.6374 85.7451 85.7814 85.9484 86.0004 86.1244 86.1576 86.2705 86.3874 86.4066 86.5654 86.6113 86.6367 86.7452 86.9490 87.0581 87.1101 87.3270 87.3831 87.4995 87.6307 87.7325 87.8742 87.9701 88.0912 88.2557 88.3156 88.3793 88.4642 88.5964 88.6929 88.7576 88.8916 88.9326 89.0741 89.1172 89.3137 89.4328 89.4930 89.6402 89.6761 89.7427 89.8480 89.9233 90.0754 90.1673 90.2578 90.3071 90.3899 90.4341 90.6397 90.6766 90.9915 91.0911 91.1819 91.1903 91.3789 91.5433 91.5836 91.7207 91.9503 91.9650 92.2361 92.3240 92.4456 92.5585 92.6624 92.8037 92.9126 93.1090 93.2177 93.3564 93.4075 93.4693 93.5775 93.6407 93.7574 93.9035 93.9461 94.0217 94.1565 94.2800 94.4346 94.4994 94.6020 94.6582 94.9192 95.0010 95.0742 95.2297 95.3298 95.4480 95.4599 95.6427 95.7903 95.8716 95.9240 96.1420 96.2581 96.4136 96.4800 96.5686 96.7853 96.9678 97.0166 97.1457 97.2827 97.3951 97.5339 97.5781 97.8377 97.8566 97.9777 98.1751 98.3718 98.3965 98.4501 98.6115 98.7351 98.8787 98.8953 99.1048 99.1849 99.2717 99.3385 99.5007 99.5433 99.6092 99.6319 99.8950 99.9789 100.0419 100.1280 100.4737 100.5262 100.7715 100.8430 100.9019 100.9112 101.0619 101.2777 101.3887 101.5393 101.7761 101.8203 101.8655 102.1951 102.2733 102.4720 102.6632 102.8493 103.0263 103.0378 103.2101 103.3064 103.5719 103.7354 103.8391 103.9355 104.1425 104.2772 104.4073 104.6383 104.7468 104.8770 104.9090 105.1711 105.2715 105.3044 105.4098 105.5301 105.7121 105.7908 105.8268 105.9496 106.0156 106.2269 106.2764 106.3057 106.5913 106.6756 106.8835 106.9949 107.1530 107.3010 107.3956 107.6913 107.8324 108.0349 108.1483 108.3390 108.3480 108.4127 108.4764 108.5433 108.6684 108.8030 108.9746 109.1670 109.1964 109.3972 109.4747 109.6803 109.7216 109.8998 109.9208 110.1924 110.3115 110.4203 110.4588 110.6104 110.7151 110.9837 111.2885 111.3597 111.4824 111.5529 111.8138 111.9068 112.0046 112.1238 112.2201 112.5417 112.6619 112.7683 112.9165 113.0485 113.1514 113.4118 113.5993 113.6488 113.7817 113.9579 114.0882 114.2152 114.3881 114.4297 114.4368 114.6733 114.8818 114.9376 115.0197 115.1689 115.2558 115.2669 115.3388 115.5202 115.5957 115.8305 115.9557 116.0710 116.2293 116.4391 116.5211 116.6401 116.7649 116.8677 117.0055 117.1079 117.3401 117.4968 117.5870 117.6228 117.7032 117.8264 117.9971 118.1760 118.3251 118.3605 118.4733 118.5327 118.5772 118.7891 118.8617 119.0060 119.0349 119.0780 119.1985 119.3202 119.4938 119.5261 119.6081 119.7678 119.8977 120.0916 120.1567 120.2699 120.3872 120.4066 120.5933 120.7284 120.8388 120.9971 121.1881 121.3356 121.7220 121.9222 122.0206 122.0334 122.2277 122.4920 122.5810 122.8334 122.9873 123.1498 123.3247 123.4083 123.5237 123.6395 123.8953 124.2647 124.3120 124.6232 124.7436 125.0579 125.4813 125.8771 125.9064 126.1175 126.2999 126.6296 126.6618 126.7455 126.8031 127.1130 127.3537 127.4574 127.6480 127.8384 127.9452 128.1860 128.2722 128.3209 128.5689 128.8260 128.9091 129.3441 129.4325 129.6581 129.7207 129.8464 130.1267 130.3674 130.6645 130.6997 131.0464 131.2659 131.3462 131.5086 131.5893 131.7912 131.8305 131.8884 132.2078 132.3004 132.4671 132.6980 132.9526 133.0693 133.1951 133.2732 133.4409 133.7386 134.1845 134.2895 134.6971 134.9825 135.1313 135.3513 135.5348 135.7089 135.8367 135.9429 135.9557 136.6464 137.0246 137.1866 137.3016 137.5022 137.6436 137.8835 138.1756 138.3595 138.4770 138.7575 138.8797 139.1410 139.1534 139.3253 139.5647 139.7708 140.0933 140.1970 140.3211 140.7444 141.1436 141.4560 141.5560 141.7263 141.9245 142.2390 142.5634 142.9226 143.0027 143.2172 143.4612 143.6627 143.7140 144.0012 144.0896 144.2521 144.4765 144.7832 144.9893 145.0533 145.2526 145.3725 146.0823 146.3626 146.5514 146.7442 147.0174 147.4179 147.6380 147.8801 148.0875 148.2479 148.4336 148.7501 148.7857 149.0570 149.2089 149.3478 149.4153 149.5521 149.7243 149.8324 150.0176 150.5460 150.5875 150.6872 150.8990 150.9222 151.1081 151.2919 151.6332 151.7240 152.2061 152.4805 152.7855 152.9125 153.0497 153.1626 153.2408 153.5094 153.9835 154.1869 154.6567 155.0671 155.1648 155.4666 155.8522 155.8645 156.0488 156.3665 156.7713 156.9199 157.0695 157.1593 157.4024 157.6228 157.8761 157.9855 158.3149 158.6073 158.9596 159.0953 159.6611 159.7400 159.9824 160.6075 161.3664 161.5173 162.3939 163.1915 163.4018 164.0083 164.4552 165.4654 168.1645 168.6366 169.6034 170.5421 171.6434 171.7660 174.4525 175.0612 176.8810 180.3301 181.1450 182.9528 185.7540 186.3177 186.4912 187.9341 188.8116 189.2473 189.5255 190.1150 190.4973 191.7020 192.3226 192.8413 193.9463 195.8471 196.3164 199.8306 201.1833 202.4079 206.2019 206.4917 207.8477 212.3935 230.4326 236.1376 241.8075 248.5310 249.1685 338.2122 618.9931 621.0566 623.0512 629.7086 630.4747 631.6164 632.6164 633.0874 634.4335 634.4915 635.1927 635.7431 637.0039 637.2929 637.9102 638.4516 639.5475 639.7688 643.1477 643.5179 645.7059 647.4686 654.0867 655.9632 658.2963 1213.6474 1215.0474 1565.7980 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 0.496655 -0.219101 -0.330176 -0.334597 -0.285405 -0.151276 -0.167597 -0.410471 -0.460576 -0.081544 -0.175755 -0.073680 0.098142 -0.235685 -0.295852 0.315297 -0.281144 -0.247593 0.229787 -0.165433 0.222481 0.042060 -0.242207 0.247473 -0.137121 -0.211119 -0.203343 -0.135973 -0.163560 0.096826 0.088820 0.093427 0.075882 0.106793 0.104456 0.100617 0.107935 0.105726 0.098759 0.096778 0.085469 0.156877 0.139138 0.138989 0.131074 0.138939 0.140909 0.149465 0.085663 0.107852 0.057911 0.086561 0.103665 0.135559 0.143087 0.167778 0.156081 0.156280 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 13.5033 9.2191 8.3302 8.3346 6.2854 6.1513 6.1676 6.4105 6.4606 6.0815 6.1758 6.0737 5.9019 6.2357 6.2959 5.6847 6.2811 6.2476 5.7702 6.1654 5.7775 5.9579 6.2422 5.7525 6.1371 6.2111 6.2033 6.1360 6.1636 0.9032 0.9112 0.9066 0.9241 0.8932 0.8955 0.8994 0.8921 0.8943 0.9012 0.9032 0.9145 0.8431 0.8609 0.8610 0.8689 0.8611 0.8591 0.8505 0.9143 0.8921 0.9421 0.9134 0.8963 0.8644 0.8569 0.8322 0.8439 0.8437 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 0.4967 -0.2191 -0.3302 -0.3346 -0.2854 -0.1513 -0.1676 -0.4105 -0.4606 -0.0815 -0.1758 -0.0737 0.0981 -0.2357 -0.2959 0.3153 -0.2811 -0.2476 0.2298 -0.1654 0.2225 0.0421 -0.2422 0.2475 -0.1371 -0.2111 -0.2033 -0.1360 -0.1636 0.0968 0.0888 0.0934 0.0759 0.1068 0.1045 0.1006 0.1079 0.1057 0.0988 0.0968 0.0855 0.1569 0.1391 0.1390 0.1311 0.1389 0.1409 0.1495 0.0857 0.1079 0.0579 0.0866 0.1037 0.1356 0.1431 0.1678 0.1561 0.1563 4.1028 1.0650 2.0626 2.0727 3.8169 3.9109 3.7656 3.8764 3.9227 3.8331 3.8337 3.8201 3.5141 3.8474 4.0041 3.7116 4.0020 3.8897 3.6950 3.8603 3.9533 3.8716 3.9137 3.7199 3.7868 3.9773 3.8755 3.9142 3.8919 1.0091 1.0101 1.0083 0.9964 1.0104 1.0071 1.0095 1.0085 1.0123 1.0112 1.0055 1.0095 0.9675 0.9862 1.0067 1.0160 1.0138 1.0034 0.9977 0.9966 0.9907 0.9994 1.0073 1.0136 1.0104 1.0097 0.9879 0.9885 0.9913 4.1028 1.0650 2.0626 2.0727 3.8169 3.9109 3.7656 3.8764 3.9227 3.8331 3.8337 3.8201 3.5141 3.8474 4.0041 3.7116 4.0020 3.8897 3.6950 3.8603 3.9533 3.8716 3.9137 3.7199 3.7868 3.9773 3.8755 3.9142 3.8919 1.0091 1.0101 1.0083 0.9964 1.0104 1.0071 1.0095 1.0085 1.0123 1.0112 1.0055 1.0095 0.9675 0.9862 1.0067 1.0160 1.0138 1.0034 0.9977 0.9966 0.9907 0.9994 1.0073 1.0136 1.0104 1.0097 0.9879 0.9885 0.9913 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 0.9342 1.0189 0.9561 0.9626 1.0021 1.0800 0.9027 0.9030 0.9640 0.9117 0.9784 0.9820 0.9273 0.9908 1.0210 1.3227 1.3133 0.9737 0.9725 0.9739 0.9758 0.9735 0.9774 0.8844 1.0101 1.0153 1.4110 0.9656 1.4709 0.9855 1.3355 1.3210 1.2818 0.9900 1.3243 1.0089 1.4087 0.9822 1.3912 1.0139 1.3641 1.4162 0.9955 0.9553 0.9971 0.9795 0.9841 0.9909 0.9875 1.3452 1.3816 1.3561 0.9696 1.4466 0.9867 1.4251 0.9759 1.4010 0.9821 0.9884 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 -0.036199248 -1510.102561908137 -20.38614 19.54108 -0.84506 12.33862 -12.67126 -0.33264 3.78387 -3.06382 0.72005 1.15899 2.94591