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:-4.0222,1.067,1.1069;1.9236,-2.9189,.8148;1.4549,3.6538,1.082;1.9058,-.7185,-.8088;-3.8556,-.5252,.1057;-3.3895,-.3139,-1.3359;-2.3165,1.868,1.1477;-4.5809,.6369,2.8536;-5.2541,2.2538,.3212;-2.7655,-1.5614,-1.9756;-1.1646,1.0892,1.2666;-2.1272,3.2492,1.035;-1.5,-1.976,-1.2767;.1125,1.6356,1.2605;-.866,3.8188,1.0311;.2704,3.0142,1.1334;-.3419,-1.211,-1.416;-1.4646,-3.0798,-.4318;.8084,-1.5258,-.7155;-.3147,-3.4104,.2752;.8064,-2.6251,.1346;2.669,2.9121,1.0787;3.1185,2.504,2.4649;3.0629,-1.2145,-1.3441;3.0994,-2.3281,-2.1726;4.2267,-.5173,-1.0435;4.3195,-2.7478,-2.6871;5.4344,-.9458,-1.5704;5.49,-2.0657,-2.3903;-3.1444,-1.1598,.6473;-4.8005,-1.0782,.1205;-2.6566,.4978,-1.3912;-4.2348,.0093,-1.949;-4.6685,1.5275,3.4797;-5.5546,.1412,2.8536;-3.8727,-.0358,3.3429;-6.2344,1.7814,.2233;-5.3943,3.1538,.9238;-4.9474,2.5727,-.6769;-3.4841,-2.3844,-1.9552;-2.5541,-1.3536,-3.028;-1.2437,.0116,1.3638;-2.9818,3.9096,.9371;.9613,.9723,1.3542;-.7503,4.8919,.9344;-.3321,-.3441,-2.0672;-2.3488,-3.6933,-.3117;-.2945,-4.2664,.9377;3.4061,3.5835,.6366;2.5889,2.0468,.4136;4.0928,2.0177,2.3965;3.2277,3.3743,3.1133;2.4342,1.8043,2.9452;2.1967,-2.8689,-2.4278;4.1839,.3511,-.397;4.3463,-3.6178,-3.3307;6.3392,-.4018,-1.3314;6.4356,-2.4007,-2.7954; 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 2922.9389580935 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 5.892e-06 Time for diagonalization 0.487 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.512 sec Total time needed 1.014 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:-4.0222,1.067,1.1069;1.9236,-2.9189,.8148;1.4549,3.6538,1.082;1.9058,-.7185,-.8088;-3.8556,-.5252,.1057;-3.3895,-.3139,-1.3359;-2.3165,1.868,1.1477;-4.5809,.6369,2.8536;-5.2541,2.2538,.3212;-2.7655,-1.5614,-1.9756;-1.1646,1.0892,1.2666;-2.1272,3.2492,1.035;-1.5,-1.976,-1.2767;.1125,1.6356,1.2605;-.866,3.8188,1.0311;.2704,3.0142,1.1334;-.3419,-1.211,-1.416;-1.4646,-3.0798,-.4318;.8084,-1.5258,-.7155;-.3147,-3.4104,.2752;.8064,-2.6251,.1346;2.669,2.9121,1.0787;3.1185,2.504,2.4649;3.0629,-1.2145,-1.3441;3.0994,-2.3281,-2.1726;4.2267,-.5173,-1.0435;4.3195,-2.7478,-2.6871;5.4344,-.9458,-1.5704;5.49,-2.0657,-2.3903;-3.1444,-1.1598,.6473;-4.8005,-1.0782,.1205;-2.6566,.4978,-1.3912;-4.2348,.0093,-1.949;-4.6685,1.5275,3.4797;-5.5546,.1412,2.8536;-3.8727,-.0358,3.3429;-6.2344,1.7814,.2233;-5.3943,3.1538,.9238;-4.9474,2.5727,-.6769;-3.4841,-2.3844,-1.9552;-2.5541,-1.3536,-3.028;-1.2437,.0116,1.3637;-2.9818,3.9096,.9371;.9613,.9723,1.3542;-.7503,4.8919,.9344;-.3321,-.3441,-2.0672;-2.3488,-3.6933,-.3117;-.2945,-4.2664,.9377;3.4061,3.5835,.6366;2.5889,2.0468,.4136;4.0928,2.0177,2.3965;3.2277,3.3743,3.1133;2.4342,1.8043,2.9452;2.1967,-2.8689,-2.4278;4.1839,.3511,-.397;4.3463,-3.6178,-3.3307;6.3392,-.4018,-1.3314;6.4356,-2.4007,-2.7954; 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:-4.0222,1.067,1.1069;1.9236,-2.9189,.8148;1.4549,3.6538,1.082;1.9058,-.7185,-.8088;-3.8556,-.5252,.1057;-3.3895,-.3139,-1.3359;-2.3165,1.868,1.1477;-4.5809,.6369,2.8536;-5.2541,2.2538,.3212;-2.7655,-1.5614,-1.9756;-1.1646,1.0892,1.2666;-2.1272,3.2492,1.035;-1.5,-1.976,-1.2767;.1125,1.6356,1.2605;-.866,3.8188,1.0311;.2704,3.0142,1.1334;-.3419,-1.211,-1.416;-1.4646,-3.0798,-.4318;.8084,-1.5258,-.7155;-.3147,-3.4104,.2752;.8064,-2.6251,.1346;2.669,2.9121,1.0787;3.1185,2.504,2.4649;3.0629,-1.2145,-1.3441;3.0994,-2.3281,-2.1726;4.2267,-.5173,-1.0435;4.3195,-2.7478,-2.6871;5.4344,-.9458,-1.5704;5.49,-2.0657,-2.3903;-3.1444,-1.1598,.6473;-4.8005,-1.0782,.1205;-2.6566,.4978,-1.3912;-4.2348,.0093,-1.949;-4.6685,1.5275,3.4797;-5.5546,.1412,2.8536;-3.8727,-.0358,3.3429;-6.2344,1.7814,.2233;-5.3943,3.1538,.9238;-4.9474,2.5727,-.6769;-3.4841,-2.3844,-1.9552;-2.5541,-1.3536,-3.028;-1.2437,.0116,1.3638;-2.9818,3.9096,.9371;.9613,.9723,1.3542;-.7503,4.8919,.9344;-.3321,-.3441,-2.0672;-2.3488,-3.6933,-.3117;-.2945,-4.2664,.9377;3.4061,3.5835,.6366;2.5889,2.0468,.4136;4.0928,2.0177,2.3965;3.2277,3.3743,3.1133;2.4342,1.8043,2.9452;2.1967,-2.8689,-2.4278;4.1839,.3511,-.397;4.3463,-3.6178,-3.3307;6.3392,-.4018,-1.3314;6.4356,-2.4007,-2.7954; 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 3367 GEPOL Volume 2917.4575 GEPOL Surface-area 1637.7515 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 0.8s) Overall time for CPCM initialization 0.9s -1510.06887651 2922.93895809 -4433.00783460 -7876.16497913 3443.15714453 -0.02278285 -3013.96956289 1503.90068639 2.00410146 108.999955537820 108.999955537820 217.999911075641 -135.228972094807 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 -1800.5797 -674.9811 -524.7171 -524.1126 -282.0682 -281.5948 -281.5900 -281.3717 -280.8962 -280.0033 -279.9366 -279.8379 -279.8148 -279.8054 -279.7916 -279.7328 -279.6939 -279.6782 -279.6675 -279.5807 -279.5023 -279.4560 -279.4352 -279.3777 -279.1755 -279.0900 -278.7812 -278.6927 -278.6596 -145.6398 -100.7069 -100.6924 -100.6845 -36.8639 -33.0384 -32.3002 -27.0934 -26.6042 -26.3817 -24.9558 -24.2335 -24.1746 -23.6551 -23.5019 -23.4166 -23.0509 -22.8470 -22.0630 -21.3854 -21.3330 -20.5850 -20.4745 -20.0898 -19.6999 -19.4597 -19.1782 -18.6311 -18.4695 -18.0640 -17.3619 -17.3276 -16.9242 -16.4117 -16.1482 -16.0772 -15.9582 -15.6870 -15.3895 -15.0529 -14.9603 -14.8182 -14.7468 -14.6953 -14.4816 -14.3074 -14.3034 -14.2392 -13.9627 -13.9115 -13.7984 -13.6395 -13.4860 -13.3655 -13.3044 -13.1459 -12.9928 -12.8977 -12.7940 -12.7047 -12.6610 -12.5508 -12.3408 -12.2817 -11.9589 -11.8213 -11.6672 -11.4459 -11.4305 -11.2518 -11.1239 -10.4479 -10.3321 -9.9452 -9.4770 -9.4727 -9.2318 -8.9739 -8.5492 -8.2546 1.3358 1.6029 1.7305 1.8016 1.9794 2.0807 3.0963 3.3302 3.5722 3.7318 3.7896 4.0001 4.0746 4.2549 4.4527 4.5649 4.6270 4.6526 4.7240 4.9127 5.0151 5.0563 5.0887 5.2178 5.2434 5.3296 5.4420 5.6089 5.6911 5.8059 5.8328 5.9167 5.9505 5.9743 6.0742 6.1506 6.2337 6.2939 6.3093 6.4257 6.5389 6.6357 6.7180 6.8769 6.9734 7.1492 7.1802 7.3734 7.4619 7.5022 7.6693 7.7665 7.8472 7.9177 7.9855 8.0483 8.1058 8.2301 8.2637 8.2964 8.3669 8.3959 8.5222 8.7547 8.8543 8.9858 9.0074 9.1476 9.2722 9.3269 9.5012 9.5428 9.6851 9.7751 9.9231 9.9662 10.0825 10.1456 10.1670 10.3025 10.4150 10.5446 10.6093 10.7032 10.7841 10.8187 11.0929 11.1453 11.2167 11.2592 11.4122 11.4324 11.5857 11.6603 11.7707 11.8392 11.9679 11.9949 12.0968 12.1140 12.2338 12.2481 12.4036 12.5269 12.6671 12.7625 12.8031 12.9240 12.9621 13.0914 13.1225 13.2028 13.3252 13.4066 13.4591 13.5142 13.5611 13.6389 13.7434 13.8095 13.9283 13.9780 14.0177 14.1178 14.1915 14.2544 14.3291 14.4278 14.4911 14.6272 14.6774 14.7526 14.8373 14.9144 14.9866 15.0276 15.1131 15.1312 15.1805 15.2887 15.3373 15.4472 15.5756 15.6155 15.7137 15.8127 15.8843 15.9518 16.0068 16.0298 16.0815 16.3032 16.4200 16.4662 16.5660 16.5940 16.7737 16.8912 17.0535 17.1034 17.1953 17.2862 17.4685 17.5249 17.7491 17.8146 17.9802 18.0320 18.1927 18.2194 18.4128 18.5591 18.6425 18.7493 18.9178 19.1325 19.2103 19.2648 19.4933 19.5244 19.6477 19.8600 19.9029 19.9425 20.0491 20.2000 20.2225 20.4084 20.4672 20.5290 20.7410 20.8700 20.9877 21.1261 21.1838 21.2397 21.3731 21.4047 21.5260 21.6690 21.7093 21.9299 21.9867 22.0281 22.0722 22.3393 22.3970 22.4678 22.6916 22.7758 22.9030 23.0714 23.1058 23.3492 23.4416 23.5219 23.6960 23.8514 23.8898 23.9721 24.0512 24.1727 24.2412 24.3998 24.5505 24.7843 24.8471 24.9152 25.0108 25.1417 25.2378 25.4544 25.5579 25.6162 25.7832 25.8923 25.9112 26.0578 26.1898 26.3377 26.4470 26.5973 26.6749 26.7955 26.8439 26.9978 27.0474 27.1626 27.2681 27.3782 27.4546 27.5121 27.9440 28.0673 28.1290 28.1970 28.3627 28.5322 28.5939 28.6312 28.7584 28.9346 28.9931 29.0401 29.3914 29.4190 29.4953 29.5557 29.6229 29.7092 29.8373 29.8816 29.9993 30.0856 30.2419 30.3962 30.5124 30.7025 30.8152 30.9594 31.0087 31.0295 31.2302 31.3058 31.3986 31.5462 31.6932 31.7795 31.8661 32.0085 32.1539 32.2603 32.3981 32.5535 32.5951 32.6511 32.8564 33.0606 33.1174 33.1985 33.2293 33.4097 33.4513 33.5880 33.6993 33.8370 33.9458 34.1205 34.1479 34.3557 34.4461 34.5437 34.5998 34.7867 34.8686 34.9327 35.2065 35.3199 35.4522 35.5899 35.6031 35.6763 35.8063 35.9838 36.0914 36.3844 36.4253 36.4839 36.6168 36.7191 36.8975 37.0785 37.1611 37.2789 37.3213 37.4291 37.5958 37.6357 37.6778 37.8207 37.9595 37.9640 38.2070 38.3499 38.4417 38.5338 38.5487 38.7540 38.8261 38.8318 38.9757 39.0497 39.1434 39.3005 39.4377 39.4757 39.5681 39.6608 39.7633 39.7951 39.9478 40.1860 40.2743 40.3540 40.5940 40.6789 40.7419 40.8072 40.9699 41.0649 41.1151 41.3097 41.3485 41.4874 41.5723 41.9094 41.9972 42.1892 42.2649 42.3754 42.4081 42.4344 42.5610 42.6699 42.7853 42.8479 42.9892 43.1365 43.2674 43.3917 43.4369 43.5355 43.6590 43.7102 43.9768 44.0569 44.2163 44.3032 44.3607 44.4070 44.6454 44.6749 44.7250 44.8936 45.0359 45.0647 45.1140 45.3472 45.3984 45.4964 45.5649 45.7020 45.8265 45.8514 45.9342 46.0381 46.3215 46.4951 46.5526 46.8084 46.8666 46.9422 47.0233 47.1459 47.3137 47.3408 47.4619 47.6568 47.9298 48.0208 48.1771 48.2368 48.2851 48.4770 48.5898 48.7685 48.8811 49.0546 49.2288 49.3735 49.4646 49.6699 49.7030 49.9621 50.1042 50.2809 50.4582 50.5461 50.7873 51.2190 51.3469 51.5752 51.6575 51.8270 52.1065 52.1701 52.2789 52.4604 52.5168 52.8830 52.9315 53.0805 53.2870 53.3002 53.5245 53.7250 53.9739 54.2241 54.5433 54.6966 54.8586 55.0893 55.2958 55.4972 55.6767 55.8274 56.0608 56.3675 56.3952 56.6277 56.7930 56.9155 56.9706 57.3702 57.3750 57.7118 57.9278 58.0539 58.2456 58.4829 58.6458 58.7898 59.0725 59.3246 59.4021 59.7703 59.8376 60.1853 60.2400 60.4962 60.5069 60.8112 61.1058 61.5012 61.6564 61.6988 61.9463 62.2017 62.3194 62.9115 63.0904 63.5123 63.5398 63.7126 63.8805 64.0625 64.3320 64.4153 64.6800 64.7586 64.8941 65.1201 65.2250 65.5227 65.5635 65.8170 66.1879 66.2475 66.6973 66.8779 67.1972 67.2858 67.3607 67.5705 67.7997 67.9925 68.2286 68.2555 68.4726 68.6160 69.0171 69.2327 69.3340 69.7666 69.8821 70.0744 70.2499 70.6339 70.6934 71.4583 71.5494 71.7297 72.0825 72.3224 72.4217 72.6224 72.7367 72.9954 73.0919 73.1557 73.3950 73.7186 73.8141 74.1093 74.1307 74.4677 74.5671 74.6677 74.8335 74.9441 75.2856 75.3347 75.4409 75.8478 76.0281 76.1282 76.2997 76.4013 76.6128 76.6483 76.7621 76.9206 77.3446 77.4706 77.6813 77.7912 77.8925 78.0025 78.1713 78.1844 78.3460 78.5123 78.5993 78.6848 78.8810 78.9236 79.0235 79.2901 79.3557 79.4552 79.5091 79.5669 79.6760 79.7055 79.9003 79.9814 80.0672 80.1941 80.3002 80.3606 80.5174 80.6475 80.7607 80.8282 80.9818 81.0506 81.1769 81.2595 81.3995 81.6674 81.7470 81.8824 81.9505 82.0966 82.1707 82.2776 82.4147 82.6375 82.7550 82.8892 83.1498 83.1851 83.4116 83.5644 83.6810 83.6952 83.8159 84.0477 84.0734 84.2554 84.3053 84.5737 84.7206 84.7897 84.8818 85.0228 85.1054 85.1867 85.2770 85.3980 85.4190 85.5085 85.6656 85.6940 85.7860 85.9133 86.0219 86.1016 86.1707 86.2112 86.3353 86.5561 86.6117 86.6484 86.8029 86.8700 86.9562 87.1016 87.1700 87.3348 87.4808 87.5616 87.6022 87.7473 87.8584 87.9552 88.0970 88.1187 88.2024 88.3139 88.3856 88.6188 88.6531 88.6958 88.8948 88.9738 89.0691 89.0894 89.1922 89.3151 89.3992 89.5037 89.5857 89.7909 89.9211 90.0344 90.0953 90.1521 90.2995 90.3156 90.4938 90.5086 90.6902 90.7505 90.9593 91.1365 91.1930 91.2612 91.3630 91.4700 91.6528 91.7493 92.0373 92.2096 92.3136 92.4744 92.4811 92.6386 92.7323 92.9452 93.1285 93.1988 93.2358 93.3137 93.3420 93.4683 93.5210 93.6759 93.8646 93.8695 94.1207 94.1832 94.3322 94.4375 94.5508 94.6816 94.7515 94.7949 95.0513 95.0777 95.1342 95.1942 95.3295 95.4192 95.5374 95.6189 95.7743 95.8177 95.9831 96.1277 96.2233 96.5360 96.7041 96.7835 96.8542 97.0023 97.0644 97.3151 97.3496 97.4613 97.6483 97.7753 97.8198 97.9814 98.0248 98.0935 98.2986 98.3574 98.5754 98.6248 98.7159 98.8749 98.9666 99.0724 99.1755 99.2702 99.3974 99.4595 99.4911 99.7629 99.8729 99.9695 100.1011 100.1791 100.2855 100.4096 100.4853 100.5767 100.7332 100.9263 101.2176 101.2264 101.5077 101.5801 101.6339 101.7720 101.9600 102.1176 102.1578 102.3833 102.5650 102.8292 102.9342 103.0607 103.1845 103.2761 103.5999 103.7192 103.9040 104.0270 104.0989 104.2945 104.3622 104.5760 104.6938 104.8179 105.0341 105.0677 105.2862 105.3729 105.4763 105.5472 105.7060 105.7572 105.9070 106.0212 106.1302 106.2863 106.3623 106.4353 106.5603 106.7939 106.9131 107.0094 107.1182 107.1761 107.5222 107.5467 107.7384 107.7744 108.0178 108.1641 108.2149 108.3564 108.4827 108.5325 108.6638 108.7615 109.0379 109.2798 109.3396 109.4239 109.4852 109.6973 109.7880 109.8395 110.0088 110.2451 110.3470 110.4064 110.5280 110.5365 110.9016 111.0161 111.1744 111.3515 111.5014 111.6438 111.7031 111.9247 111.9719 112.1459 112.2755 112.6005 112.7130 112.8752 112.9893 113.2332 113.3490 113.4403 113.6056 113.6563 113.7702 113.8751 114.0982 114.1295 114.3230 114.3953 114.4420 114.6641 114.6882 114.7747 114.8542 114.9603 115.1665 115.2650 115.3801 115.5465 115.6341 115.8091 115.8919 116.0197 116.1398 116.2913 116.3425 116.6030 116.6553 116.7581 117.0231 117.1382 117.2694 117.4216 117.6150 117.8178 117.8490 118.0725 118.1074 118.1841 118.2386 118.3126 118.3937 118.5258 118.6611 118.7276 118.7960 118.8240 118.9362 119.1222 119.2636 119.4529 119.5603 119.6237 119.6794 119.7774 119.8797 119.9884 120.0886 120.2912 120.3789 120.6460 120.7309 120.8041 120.9075 121.0692 121.2178 121.2227 121.3933 121.5969 121.7346 122.0568 122.1690 122.2266 122.2804 122.7163 122.9542 123.0054 123.3297 123.5485 123.7340 123.7827 124.1992 124.3169 124.7030 124.7974 125.0187 125.2250 125.5596 126.0640 126.1800 126.4651 126.5240 126.6814 126.8365 126.8651 126.9305 127.0743 127.2814 127.3791 127.6906 127.7646 127.8358 128.1678 128.2384 128.4309 128.4833 128.8066 129.1219 129.3199 129.3633 129.6198 129.8422 129.9342 130.1925 130.2779 130.5851 130.7150 130.9370 131.2308 131.3216 131.4029 131.5871 131.6418 131.8238 132.0037 132.0487 132.2658 132.5619 132.6764 132.8285 133.0777 133.4662 133.5511 133.6609 133.9822 134.5497 134.7153 134.7978 135.1847 135.3652 135.4886 135.5347 135.7329 136.0989 136.2143 136.5971 136.8227 136.9033 137.0843 137.4267 137.4863 137.9330 138.1113 138.3356 138.5157 138.5888 138.6190 138.9358 139.1803 139.4043 139.5006 139.7844 140.0934 140.3549 140.5295 140.5837 141.1131 141.3419 141.5640 141.6541 141.9846 142.1335 142.4998 142.8255 143.0760 143.3907 143.5156 143.6295 143.7220 144.0264 144.1567 144.2249 144.3896 144.5706 144.8064 144.9243 145.2392 145.3075 145.6343 146.1395 146.5393 146.6952 147.0945 147.5347 147.5830 147.7310 147.8874 148.1944 148.2203 148.4205 148.6149 148.6580 149.0792 149.1073 149.1288 149.4817 149.6681 149.6812 149.9463 149.9557 150.3184 150.4926 150.6493 150.8477 150.8871 151.1000 151.2285 151.5480 152.1458 152.2485 152.6062 152.8247 153.0641 153.2120 153.3743 153.6772 154.1133 154.2409 154.4367 154.8137 155.2993 155.3610 155.7410 155.8542 156.3067 156.3364 156.7329 156.8796 157.0527 157.0699 157.1653 157.4859 157.7234 157.9165 158.0296 158.5627 158.7863 159.0910 159.3050 159.5297 160.0534 160.3132 161.2259 161.3621 161.9346 162.9547 163.1853 163.9839 164.6187 165.4583 168.0939 168.2715 169.5946 170.8211 171.3592 171.6810 174.1802 175.1408 177.1898 180.3613 180.8832 182.9296 186.1957 186.2905 186.4680 187.9791 189.1811 189.3746 189.5906 190.4860 190.5529 192.0551 192.2642 192.8521 193.8233 195.5071 196.2162 199.8960 201.9612 202.3437 206.2198 207.2417 207.8637 212.4155 230.2927 236.0167 241.2346 248.1803 249.1043 338.6299 618.9017 619.8465 621.1757 629.7506 630.2649 631.7857 632.6212 632.7877 634.2739 634.4300 635.1840 635.4788 636.8434 637.1992 637.7278 639.1205 639.9194 640.2563 642.8408 643.2365 645.3180 646.6188 654.0429 655.7362 658.1198 1212.7284 1217.0460 1565.1373 -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 0.471133 -0.218346 -0.339440 -0.325665 -0.268936 -0.138362 -0.175830 -0.413099 -0.448336 -0.089720 -0.172744 -0.081953 0.034634 -0.232688 -0.294571 0.361293 -0.219672 -0.180808 0.130399 -0.161405 0.255989 0.066667 -0.260272 0.290830 -0.178767 -0.252172 -0.161799 -0.135329 -0.181614 0.076288 0.093508 0.080235 0.092661 0.100408 0.100286 0.100017 0.109279 0.105369 0.108364 0.083057 0.097778 0.135313 0.135740 0.131191 0.131335 0.132682 0.143873 0.148215 0.110353 0.058993 0.091093 0.092435 0.089796 0.151189 0.151223 0.157918 0.155703 0.156282 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 13.5289 9.2183 8.3394 8.3257 6.2689 6.1384 6.1758 6.4131 6.4483 6.0897 6.1727 6.0820 5.9654 6.2327 6.2946 5.6387 6.2197 6.1808 5.8696 6.1614 5.7440 5.9333 6.2603 5.7092 6.1788 6.2522 6.1618 6.1353 6.1816 0.9237 0.9065 0.9198 0.9073 0.8996 0.8997 0.9000 0.8907 0.8946 0.8916 0.9169 0.9022 0.8647 0.8643 0.8688 0.8687 0.8673 0.8561 0.8518 0.8896 0.9410 0.9089 0.9076 0.9102 0.8488 0.8488 0.8421 0.8443 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 0.4711 -0.2183 -0.3394 -0.3257 -0.2689 -0.1384 -0.1758 -0.4131 -0.4483 -0.0897 -0.1727 -0.0820 0.0346 -0.2327 -0.2946 0.3613 -0.2197 -0.1808 0.1304 -0.1614 0.2560 0.0667 -0.2603 0.2908 -0.1788 -0.2522 -0.1618 -0.1353 -0.1816 0.0763 0.0935 0.0802 0.0927 0.1004 0.1003 0.1000 0.1093 0.1054 0.1084 0.0831 0.0978 0.1353 0.1357 0.1312 0.1313 0.1327 0.1439 0.1482 0.1104 0.0590 0.0911 0.0924 0.0898 0.1512 0.1512 0.1579 0.1557 0.1563 4.1475 1.0669 2.0827 2.0183 3.8433 3.8683 3.7463 3.8856 3.9079 3.8535 3.8691 3.8425 3.5942 3.8657 4.0544 3.7273 3.9409 3.8602 3.6287 3.9069 4.0039 3.8621 3.9033 3.7188 3.8916 3.9573 3.9223 3.9218 3.9002 1.0170 1.0147 1.0019 1.0072 1.0099 1.0092 1.0091 1.0083 1.0088 1.0053 1.0079 1.0058 0.9850 0.9880 1.0155 1.0153 1.0197 1.0013 0.9988 0.9939 1.0171 1.0095 1.0065 1.0022 1.0027 1.0038 0.9908 0.9914 0.9904 4.1475 1.0669 2.0827 2.0183 3.8433 3.8683 3.7463 3.8856 3.9079 3.8535 3.8691 3.8425 3.5942 3.8657 4.0544 3.7273 3.9409 3.8602 3.6287 3.9069 4.0039 3.8621 3.9033 3.7188 3.8916 3.9573 3.9223 3.9218 3.9002 1.0170 1.0147 1.0019 1.0072 1.0099 1.0092 1.0091 1.0083 1.0088 1.0053 1.0079 1.0058 0.9850 0.9880 1.0155 1.0153 1.0197 1.0013 0.9988 0.9939 1.0171 1.0095 1.0065 1.0022 1.0027 1.0038 0.9908 0.9914 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 0.9598 1.0322 0.9601 0.9671 1.0331 1.0856 0.9023 0.8359 1.0012 0.9083 0.9863 0.9783 0.9249 1.0129 0.9930 1.3227 1.3015 0.9753 0.9708 0.9747 0.9715 0.9737 0.9742 0.8995 1.0139 1.0088 1.4233 0.9796 1.4919 0.9890 1.3408 1.3420 1.2905 0.9726 1.3456 0.9958 1.4008 1.0005 1.3964 0.9964 1.3643 1.4495 0.9845 0.9494 0.9796 0.9992 0.9820 0.9897 0.9899 1.3501 1.3540 1.4188 0.9721 1.4584 0.9751 1.4283 0.9774 1.3953 0.9816 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 -0.032019216 -1510.100895724190 -19.57477 19.23561 -0.33916 11.57051 -12.44538 -0.87487 3.52773 -4.10847 -0.58073 1.10348 2.80482