Orca 5.0.2 RELEASE 1 2 3 4 14s9p3d1f 11s6p2d1f 11s6p2d1f 5s2p1d 5s5p3d1f 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 S O O 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 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 2 2 2 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 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 4 372.3086999999997 AuxInfo=1/0/N:9,10,28,26,27,24,25,14,16,22,19,11,20,17,23,18,13,21,7,8,12,15,6,3,4,5,2,1/E:(1,2)(4,5)(6,7)/CRV:3.3,4.3,5.3,6.3,7.3,11.3,12.3,13.3,15.3,16.3,17.3,18.3,21.3,22.3,24.1,25.1/rA:52nSOO1O1OCCCCCC3C3C3CC3CCC3C3C3C3CC3C3C3C3C3C3HHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;s6;s6s7;s6;s6;s7;s2s3s8;s11;s13;s1s4s13;s1s14;s2;s17;s18;s5s18;s5s19;s21;s22;s23;s23;s24;s25;s26s27;s7;s8;s9;s9;s9;s10;s10;s10;s11;s14;s14;s16;s16;s17;s17;s19;s20;s22;s22;s24;s25;s26;s27;s28;/rC:-.0512,.3759,-3.8327;1.8681,.9271,.8728;3.8608,1.8589,1.2343;-.9558,-1.0287,-1.8052;-1.8651,2.084,-.9884;3.3527,-1.7505,1.2162;3.0858,-1.4883,-.224;3.7764,-.4181,.6127;2.2138,-1.8349,2.2016;4.4938,-2.6798,1.5557;1.7172,-1.3436,-.7661;3.1854,.893,.9443;1.4136,-.5964,-1.829;2.3281,.3092,-2.5874;.0232,-.5392,-2.3229;1.7598,.4751,-3.9947;1.1891,2.187,1.0103;-.1621,2.001,.4288;-1.2427,1.2199,.9547;-.597,2.4899,-.754;-2.2498,1.3026,.0542;-3.6163,.7196,-.0205;-3.8983,-.1954,1.1387;-4.719,.2131,2.1842;-3.3301,-1.4669,1.1879;-4.9726,-.6308,3.2586;-3.5787,-2.3109,2.2603;-4.4022,-1.895,3.2996;3.7702,-1.9558,-.9286;4.8428,-.3277,.4423;1.8759,-2.8701,2.2761;2.5463,-1.5274,3.1942;1.3473,-1.2328,1.9404;4.15,-3.7156,1.5703;5.3047,-2.6081,.8302;4.9031,-2.4512,2.541;.9276,-1.9167,-.2891;3.3497,-.0675,-2.6332;2.3605,1.2835,-2.0892;2.0921,-.3217,-4.6583;2.0256,1.4307,-4.44;1.1434,2.4575,2.0667;1.7301,2.9702,.4776;-1.2509,.6691,1.882;-.1381,3.1226,-1.4976;-4.3589,1.522,-.0507;-3.7196,.1711,-.9622;-5.1681,1.1988,2.1571;-2.6865,-1.7977,.3811;-5.6175,-.2991,4.062;-3.1309,-3.296,2.2837;-4.5989,-2.5547,4.1347; 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 1638 RIJ-COSX (HFX calculated with COS-X)) on IntName inp HFTyp RHF Charge 0 Mult 1 NEL 210 Dim 1215 ENuc 2840.9611652806 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 7.282e-06 Time for diagonalization 0.672 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.682 sec Total time needed 1.362 sec 16 8 8 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 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 372.3086999999997 AuxInfo=1/0/N:9,10,28,26,27,24,25,14,16,22,19,11,20,17,23,18,13,21,7,8,12,15,6,3,4,5,2,1/E:(1,2)(4,5)(6,7)/CRV:3.3,4.3,5.3,6.3,7.3,11.3,12.3,13.3,15.3,16.3,17.3,18.3,21.3,22.3,24.1,25.1/rA:52nSOO1O1OCCCCCC3C3C3CC3CCC3C3C3C3CC3C3C3C3C3C3HHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;s6;s6s7;s6;s6;s7;s2s3s8;s11;s13;s1s4s13;s1s14;s2;s17;s18;s5s18;s5s19;s21;s22;s23;s23;s24;s25;s26s27;s7;s8;s9;s9;s9;s10;s10;s10;s11;s14;s14;s16;s16;s17;s17;s19;s20;s22;s22;s24;s25;s26;s27;s28;/rC:-.0512,.3759,-3.8327;1.8681,.9271,.8728;3.8608,1.8589,1.2343;-.9558,-1.0287,-1.8052;-1.8651,2.084,-.9884;3.3527,-1.7505,1.2162;3.0858,-1.4883,-.224;3.7764,-.4181,.6127;2.2138,-1.8349,2.2016;4.4938,-2.6798,1.5557;1.7172,-1.3436,-.7661;3.1854,.893,.9443;1.4136,-.5964,-1.829;2.3281,.3092,-2.5874;.0232,-.5392,-2.3229;1.7598,.4751,-3.9947;1.1891,2.187,1.0103;-.1621,2.001,.4288;-1.2427,1.2199,.9547;-.597,2.4899,-.754;-2.2498,1.3026,.0542;-3.6163,.7196,-.0205;-3.8983,-.1954,1.1387;-4.719,.2131,2.1842;-3.3301,-1.4669,1.1879;-4.9726,-.6308,3.2586;-3.5787,-2.3109,2.2603;-4.4022,-1.895,3.2996;3.7702,-1.9558,-.9287;4.8428,-.3277,.4423;1.8759,-2.8701,2.2761;2.5463,-1.5274,3.1942;1.3473,-1.2328,1.9404;4.15,-3.7156,1.5703;5.3047,-2.6081,.8302;4.9031,-2.4512,2.541;.9276,-1.9167,-.2891;3.3497,-.0675,-2.6332;2.3605,1.2835,-2.0893;2.0921,-.3217,-4.6583;2.0256,1.4307,-4.44;1.1434,2.4575,2.0667;1.7301,2.9702,.4776;-1.2509,.6691,1.882;-.1381,3.1226,-1.4976;-4.3589,1.522,-.0507;-3.7196,.1711,-.9622;-5.1681,1.1988,2.1571;-2.6865,-1.7977,.3811;-5.6175,-.2991,4.062;-3.1309,-3.296,2.2837;-4.5989,-2.5547,4.1347; 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" 372.3086999999997 AuxInfo=1/0/N:9,10,28,26,27,24,25,14,16,22,19,11,20,17,23,18,13,21,7,8,12,15,6,3,4,5,2,1/E:(1,2)(4,5)(6,7)/CRV:3.3,4.3,5.3,6.3,7.3,11.3,12.3,13.3,15.3,16.3,17.3,18.3,21.3,22.3,24.1,25.1/rA:52nSOO1O1OCCCCCC3C3C3CC3CCC3C3C3C3CC3C3C3C3C3C3HHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;s6;s6s7;s6;s6;s7;s2s3s8;s11;s13;s1s4s13;s1s14;s2;s17;s18;s5s18;s5s19;s21;s22;s23;s23;s24;s25;s26s27;s7;s8;s9;s9;s9;s10;s10;s10;s11;s14;s14;s16;s16;s17;s17;s19;s20;s22;s22;s24;s25;s26;s27;s28;/rC:-.0512,.3759,-3.8327;1.8681,.9271,.8728;3.8608,1.8589,1.2343;-.9558,-1.0287,-1.8052;-1.8651,2.084,-.9884;3.3527,-1.7505,1.2162;3.0858,-1.4883,-.224;3.7764,-.4181,.6127;2.2138,-1.8349,2.2016;4.4938,-2.6798,1.5557;1.7172,-1.3436,-.7661;3.1854,.893,.9443;1.4136,-.5964,-1.829;2.3281,.3092,-2.5874;.0232,-.5392,-2.3229;1.7598,.4751,-3.9947;1.1891,2.187,1.0103;-.1621,2.001,.4288;-1.2427,1.2199,.9547;-.597,2.4899,-.754;-2.2498,1.3026,.0542;-3.6163,.7196,-.0205;-3.8983,-.1954,1.1387;-4.719,.2131,2.1842;-3.3301,-1.4669,1.1879;-4.9726,-.6308,3.2586;-3.5787,-2.3109,2.2603;-4.4022,-1.895,3.2996;3.7702,-1.9558,-.9286;4.8428,-.3277,.4423;1.8759,-2.8701,2.2761;2.5463,-1.5274,3.1942;1.3473,-1.2328,1.9404;4.15,-3.7156,1.5703;5.3047,-2.6081,.8302;4.9031,-2.4512,2.541;.9276,-1.9167,-.2891;3.3497,-.0675,-2.6332;2.3605,1.2835,-2.0892;2.0921,-.3217,-4.6583;2.0256,1.4307,-4.44;1.1434,2.4575,2.0667;1.7301,2.9702,.4776;-1.2509,.6691,1.882;-.1381,3.1226,-1.4976;-4.3589,1.522,-.0507;-3.7196,.1711,-.9622;-5.1681,1.1988,2.1571;-2.6865,-1.7977,.3811;-5.6175,-.2991,4.062;-3.1309,-3.296,2.2837;-4.5989,-2.5547,4.1347; Epsilon 78.3550 Refrac 1.3328 Rsolv 1.3000 Surface type GAUSSIAN VDW Epsilon function type CPCM S O C H 2.4900 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 3067 GEPOL Volume 2747.2960 GEPOL Surface-area 1537.0782 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 1.2s) Overall time for CPCM initialization 1.3s -1590.09370573 2840.96116528 -4431.05487101 -7823.03938323 3391.98451222 -0.04538170 -3174.31084212 1584.21713638 2.00370945 105.000036747297 105.000036747297 210.000073494595 -135.010074107724 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 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 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 -2420.7493 -525.2160 -524.7157 -523.3531 -523.0634 -283.4329 -282.9007 -281.3170 -281.2076 -280.9176 -280.5066 -280.3864 -280.2351 -280.1596 -280.1312 -280.0620 -280.0029 -279.8780 -279.8712 -279.7805 -279.6643 -279.6610 -279.6264 -279.6216 -279.6173 -279.4344 -279.2002 -279.1895 -219.2941 -163.6003 -163.4983 -163.4033 -33.7048 -33.6438 -32.0651 -31.0766 -27.5455 -26.7553 -26.5533 -25.5482 -25.0295 -24.5308 -23.6298 -23.4590 -23.3227 -22.8359 -22.6640 -21.8930 -21.6846 -21.4026 -20.3410 -19.4628 -19.4075 -19.1528 -18.7600 -18.3942 -17.9443 -17.6047 -17.2444 -16.9683 -16.6612 -16.3389 -16.2673 -16.1923 -16.0545 -15.8442 -15.6165 -15.3619 -15.1723 -15.0388 -14.8998 -14.6695 -14.4449 -14.2110 -14.1417 -14.0399 -14.0151 -13.9454 -13.7112 -13.5143 -13.3885 -13.2667 -13.2009 -13.0580 -12.8789 -12.7880 -12.7424 -12.5845 -12.4298 -12.2401 -11.7695 -11.7390 -11.6734 -11.6006 -11.1695 -11.1304 -10.6025 -10.2370 -10.0853 -9.7393 -9.6250 -9.3459 -9.1467 -9.0663 -8.4342 0.2346 1.6416 1.7261 2.1781 2.2974 2.5805 3.0784 3.2584 3.4198 3.6264 3.7485 3.8619 4.1789 4.2486 4.3396 4.5070 4.6251 4.7455 4.9353 4.9739 5.0361 5.1294 5.2411 5.2806 5.3276 5.3946 5.4990 5.6490 5.6891 5.8813 5.9973 6.0916 6.2043 6.3212 6.3766 6.5237 6.6444 6.6754 6.7464 6.8419 6.9644 7.0573 7.1765 7.1985 7.3451 7.3720 7.4589 7.6658 7.6789 7.8800 8.0103 8.1428 8.2332 8.2955 8.4308 8.4773 8.6512 8.7055 8.7760 8.9058 9.0144 9.1063 9.1883 9.3075 9.3531 9.4602 9.5836 9.6747 9.8290 9.9273 10.0994 10.1347 10.2299 10.3666 10.4459 10.5874 10.7010 10.8134 10.8507 11.0329 11.0645 11.1686 11.2783 11.3205 11.3786 11.5160 11.6992 11.8097 11.8467 11.8946 12.0346 12.1695 12.2059 12.3879 12.4693 12.5100 12.6263 12.6631 12.7462 12.8753 12.9724 13.0706 13.1584 13.2258 13.3065 13.4221 13.5385 13.6466 13.6947 13.7864 13.8931 13.9247 13.9606 14.0784 14.1425 14.2892 14.3391 14.3966 14.4483 14.5656 14.6272 14.6711 14.8648 14.9315 14.9577 15.0873 15.1117 15.2816 15.3173 15.4186 15.5695 15.6405 15.7127 15.8025 15.8981 16.0126 16.1000 16.1317 16.1691 16.3823 16.4688 16.4968 16.5797 16.8053 16.8978 16.9633 17.0549 17.2240 17.3160 17.3901 17.4884 17.5920 17.6569 17.8525 18.0434 18.1606 18.3452 18.3934 18.4930 18.5753 18.6232 18.8277 18.8909 19.0113 19.1227 19.3116 19.5345 19.6697 19.7457 19.8544 19.9270 20.3259 20.3397 20.4633 20.5285 20.6992 20.8993 20.9412 20.9829 21.1989 21.2536 21.5115 21.5717 21.7201 21.8446 21.9882 22.0919 22.2369 22.4428 22.6382 22.7921 22.8541 22.9073 23.0920 23.1983 23.3541 23.4428 23.5557 23.7778 23.8149 24.0440 24.1454 24.2178 24.3339 24.3936 24.7285 24.7470 24.9096 24.9679 25.1880 25.3878 25.4919 25.5245 25.6468 25.7369 25.7654 26.1805 26.2534 26.3716 26.5328 26.6508 26.7499 27.0633 27.1638 27.2684 27.3560 27.3666 27.7622 27.7685 27.9794 28.0999 28.2025 28.2634 28.4599 28.5659 28.7197 28.7919 28.8611 28.9750 29.1481 29.2048 29.3234 29.3937 29.6106 29.7440 29.8500 29.9211 29.9560 30.0763 30.1103 30.3164 30.3767 30.5269 30.6706 30.9342 31.0612 31.1880 31.3579 31.4877 31.5503 31.7073 31.8418 32.0062 32.1469 32.2265 32.3297 32.3739 32.4578 32.7355 32.8569 32.9254 32.9645 33.2216 33.2763 33.4695 33.5279 33.6964 33.7964 33.9605 34.0357 34.2573 34.2872 34.4257 34.5945 34.7097 34.8882 34.9863 35.1400 35.2302 35.3670 35.5710 35.7581 35.8373 36.0029 36.1466 36.2689 36.3682 36.5144 36.6476 36.8303 36.9815 37.0865 37.2186 37.2481 37.3992 37.5110 37.5987 37.6711 37.9705 38.1585 38.1956 38.3986 38.4843 38.7308 38.8345 38.9249 39.0492 39.1375 39.1762 39.4405 39.5352 39.6143 39.6591 39.8905 40.0337 40.1432 40.2307 40.3375 40.4129 40.5702 40.6971 40.8336 41.0145 41.1821 41.2367 41.3320 41.4144 41.5362 41.6496 41.9658 42.0354 42.1261 42.2954 42.3409 42.4160 42.4872 42.7122 42.8157 43.0099 43.1735 43.2689 43.4141 43.4618 43.5767 43.6073 43.7994 43.9515 44.0088 44.1279 44.3814 44.5028 44.5999 44.6697 44.7689 44.9265 45.0909 45.1371 45.3155 45.3652 45.5508 45.6383 45.7195 45.8095 45.9496 46.1658 46.1736 46.4011 46.4880 46.5952 46.7690 46.8891 46.9084 47.2442 47.3923 47.4056 47.5304 47.7383 47.8556 47.9123 48.0136 48.2277 48.3374 48.4301 48.6070 48.8689 49.0525 49.2349 49.3918 49.4529 49.6361 49.7809 49.8937 50.1391 50.1949 50.4153 50.7348 50.7606 50.8824 51.0163 51.2427 51.3626 51.6998 51.8520 52.2232 52.3884 52.5351 52.6753 52.8463 53.1577 53.2395 53.3131 53.6287 53.7105 53.8761 54.1770 54.5991 54.9254 54.9626 55.0423 55.1766 55.4852 55.5458 55.7261 56.0277 56.1872 56.3312 56.6055 56.6430 56.7644 56.9825 57.1152 57.5347 57.8255 58.1055 58.1747 58.3198 58.5693 58.7154 58.8037 59.1180 59.3183 59.5210 59.8098 59.9326 60.0409 60.1944 60.3566 60.7496 60.9090 60.9575 61.4134 61.5888 61.6619 62.0997 62.1934 62.4056 62.7123 63.1373 63.2496 63.5466 63.7995 63.9051 64.1263 64.2195 64.3033 64.7583 64.8582 65.0500 65.1359 65.2008 65.5078 65.7407 65.9374 65.9729 66.0235 66.7326 66.9337 67.2083 67.4082 67.5439 67.8209 67.9560 68.2139 68.6462 69.1013 69.2333 69.3516 69.9756 70.0446 70.5182 70.6847 71.0160 71.0872 71.2108 71.4281 71.7788 72.0613 72.1756 72.3559 72.4506 72.5377 72.8055 73.0704 73.2927 73.6878 73.7575 74.0853 74.2163 74.3546 74.5390 74.5841 74.9186 75.0131 75.2043 75.4928 75.5951 75.7164 75.9718 76.1105 76.2897 76.4369 76.7246 76.8107 76.8757 77.0023 77.2144 77.3865 77.5172 77.6784 77.7336 77.8333 77.9633 78.0863 78.3932 78.5425 78.6382 78.7839 78.9200 79.1173 79.2030 79.2832 79.3937 79.5219 79.5871 79.8491 79.8731 80.0137 80.1336 80.3232 80.4203 80.6181 80.8606 80.9657 81.1264 81.1432 81.3195 81.5282 81.6826 81.7989 81.8597 82.1276 82.3084 82.4368 82.5743 82.6815 82.8667 83.0930 83.3723 83.4207 83.6335 83.6642 83.8233 84.0537 84.2396 84.3026 84.3814 84.4954 84.5457 84.6400 84.6660 84.7407 85.0119 85.0770 85.2086 85.2488 85.4615 85.5080 85.6032 85.7516 85.8120 85.8773 86.0322 86.2634 86.2947 86.4341 86.5178 86.6097 86.7159 86.8299 87.0169 87.1280 87.2647 87.4333 87.4989 87.6270 87.7432 87.8096 87.9382 88.1450 88.2288 88.4053 88.4590 88.4813 88.6862 88.7348 88.8258 89.0329 89.1718 89.2256 89.3279 89.4691 89.5318 89.5864 89.7237 89.8424 89.9288 90.1271 90.1660 90.3570 90.5179 90.7130 90.8702 91.0280 91.1572 91.2889 91.4925 91.5554 91.7094 91.8363 91.9903 92.0008 92.1664 92.3742 92.4307 92.5119 92.6212 92.6901 92.9197 93.0070 93.1035 93.1790 93.3244 93.4370 93.5906 93.6439 93.8202 93.8964 93.9751 94.1420 94.1687 94.1863 94.3131 94.5675 94.7794 94.8660 94.8953 95.1433 95.1843 95.3763 95.4346 95.5535 95.6528 95.7717 95.8225 95.9620 96.0008 96.1587 96.3054 96.4175 96.6305 96.7196 97.0386 97.2231 97.3058 97.3327 97.3921 97.5701 97.6651 97.7946 97.8273 98.0653 98.1473 98.3997 98.4868 98.6306 98.7797 98.8501 99.1587 99.2355 99.3176 99.5351 99.6627 99.7762 99.8385 100.0561 100.2385 100.4195 100.4852 100.7039 100.8062 100.9387 101.0283 101.2442 101.4253 101.7222 101.8431 101.9869 102.2629 102.3407 102.3766 102.5486 102.8281 102.9172 103.0445 103.1032 103.1629 103.2499 103.3718 103.4270 103.6251 103.8024 103.9362 104.0238 104.2302 104.3622 104.5601 104.7313 104.9404 105.1965 105.3381 105.4449 105.5731 105.6416 105.7134 105.9296 105.9712 105.9902 106.3524 106.5822 106.8308 106.9034 107.0490 107.0933 107.2930 107.3159 107.4686 107.5255 107.6401 107.8573 107.9838 108.3448 108.4233 108.6429 108.6573 108.8825 109.2127 109.3387 109.4291 109.4932 109.6891 109.7251 109.9733 110.1579 110.2665 110.5268 110.6328 110.7737 110.8798 111.0509 111.1127 111.3421 111.4614 111.5912 111.8402 111.9925 112.0842 112.1386 112.1794 112.4714 112.5184 112.7586 112.9045 112.9743 113.2753 113.4555 113.5847 113.8240 113.9248 114.0393 114.3368 114.5098 114.6862 114.8190 114.9163 115.1051 115.2696 115.3291 115.6464 115.7576 115.9164 116.0891 116.1127 116.2353 116.3913 116.5508 116.7768 116.8996 117.0305 117.1784 117.2941 117.4914 117.6368 117.8025 117.9418 118.0948 118.1449 118.2593 118.3027 118.3367 118.4181 118.5161 118.7460 118.7802 118.9300 118.9809 119.1418 119.1581 119.3138 119.4376 119.5720 119.9140 120.0255 120.1188 120.2659 120.3579 120.5960 120.7137 120.8102 121.1983 121.2528 121.5003 121.8030 121.9581 122.1652 122.4364 122.7362 122.9904 123.1447 123.3814 123.5390 123.6870 123.8293 124.1559 124.3121 124.5225 124.6520 124.8458 125.0971 125.1554 125.5462 126.0191 126.0880 126.2087 126.6309 126.7071 126.8919 127.3227 127.7710 127.9361 128.2245 128.3247 128.6464 128.7669 128.9967 129.2560 129.3883 129.5479 129.6647 129.9269 130.0257 130.3588 130.6465 130.7984 131.0518 131.2941 131.5831 131.6958 131.7840 132.0146 132.0736 132.2611 132.4029 132.5974 133.0128 133.1152 133.2380 133.2658 133.4360 133.6824 133.8978 134.1663 134.3632 134.5277 134.6265 134.9052 135.0709 135.3642 135.4849 135.8318 136.1413 136.6989 136.7618 137.0115 137.2341 137.7566 138.1873 138.3241 138.6622 138.7125 138.8216 139.2068 139.2489 139.4014 139.9567 140.1810 140.4809 140.6634 141.0892 141.2134 141.5973 141.8515 142.1589 142.2176 142.6127 142.7822 143.0461 143.1735 143.3058 143.5288 143.6673 143.9180 144.1762 144.4127 144.5662 144.7054 144.9691 145.1164 145.3900 145.5393 145.7835 145.9919 146.1309 146.3584 146.6077 147.0511 147.1690 147.4920 147.6289 148.0681 148.3434 148.6806 148.8124 148.9416 149.2937 149.3770 149.5195 149.9224 150.0657 150.2187 150.4515 150.5966 150.6215 151.0883 151.3645 151.4399 151.7937 152.3381 152.4442 152.4906 152.6344 152.7228 152.9167 153.3266 153.3606 153.5582 154.1812 154.2073 154.4575 154.9269 155.1491 155.4409 155.6787 155.7237 156.0006 156.3391 156.7217 156.9252 157.3848 157.8974 158.2078 158.7536 159.1068 159.1373 159.3181 159.4825 159.5086 160.2924 160.6682 160.9065 161.1608 161.4032 161.6508 162.3719 162.7718 163.3393 163.8966 164.7265 167.1197 168.1466 168.5421 169.1872 169.5670 170.0818 171.9872 172.5755 173.2031 175.5004 176.3000 176.7407 176.8045 178.5447 179.3122 179.6838 180.8409 181.2290 184.9994 185.3033 187.3103 187.6301 188.0461 188.4393 188.5557 188.7686 188.8417 189.4070 189.9757 190.1436 190.5991 193.4249 194.3621 195.1276 195.6885 196.4532 198.9816 201.4043 201.6749 204.5327 206.2895 207.5091 247.0222 260.2644 260.8689 544.7339 620.2185 621.8771 624.5266 625.5431 632.6315 632.7754 633.5964 634.0153 634.7549 635.2799 636.9357 637.3681 638.2763 639.6404 639.8728 642.3349 642.5309 644.5380 645.2145 647.9483 651.2463 652.4396 659.4923 1198.5929 1200.7804 1207.2533 1211.9554 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 S O O 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 H H H H H H H H H H H H H H H H H H H H H H H H -0.062143 -0.254279 -0.507171 -0.463958 -0.283919 0.111730 -0.036502 -0.134310 -0.279316 -0.267377 -0.086052 0.444749 -0.112005 -0.117722 0.306716 -0.119311 0.053780 -0.092745 -0.272899 -0.036760 0.154151 -0.011348 0.013695 -0.183968 -0.214208 -0.159846 -0.159264 -0.170851 0.119758 0.097240 0.101449 0.104445 0.085961 0.094512 0.089890 0.098288 0.136025 0.104544 0.101013 0.119054 0.121585 0.127000 0.113449 0.160217 0.177717 0.106778 0.110675 0.141737 0.148466 0.160122 0.159826 0.161385 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 S O O 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 H H H H H H H H H H H H H H H H H H H H H H H H 16.0621 8.2543 8.5072 8.4640 8.2839 5.8883 6.0365 6.1343 6.2793 6.2674 6.0861 5.5553 6.1120 6.1177 5.6933 6.1193 5.9462 6.0927 6.2729 6.0368 5.8458 6.0113 5.9863 6.1840 6.2142 6.1598 6.1593 6.1709 0.8802 0.9028 0.8986 0.8956 0.9140 0.9055 0.9101 0.9017 0.8640 0.8955 0.8990 0.8809 0.8784 0.8730 0.8866 0.8398 0.8223 0.8932 0.8893 0.8583 0.8515 0.8399 0.8402 0.8386 16.0000 8.0000 8.0000 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 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 -0.0621 -0.2543 -0.5072 -0.4640 -0.2839 0.1117 -0.0365 -0.1343 -0.2793 -0.2674 -0.0861 0.4447 -0.1120 -0.1177 0.3067 -0.1193 0.0538 -0.0927 -0.2729 -0.0368 0.1542 -0.0113 0.0137 -0.1840 -0.2142 -0.1598 -0.1593 -0.1709 0.1198 0.0972 0.1014 0.1044 0.0860 0.0945 0.0899 0.0983 0.1360 0.1045 0.1010 0.1191 0.1216 0.1270 0.1134 0.1602 0.1777 0.1068 0.1107 0.1417 0.1485 0.1601 0.1598 0.1614 2.4364 2.1162 1.9910 2.0122 2.2427 3.7718 3.8414 3.9071 3.9105 3.9076 3.8038 4.0743 3.5499 3.9743 4.1113 3.9580 3.8559 3.7378 3.9340 3.8953 3.6581 3.8005 3.5986 3.9396 3.9089 3.8913 3.9080 3.8912 1.0059 1.0285 0.9993 1.0009 1.0068 1.0020 1.0046 1.0012 1.0066 1.0058 1.0103 1.0070 1.0066 0.9914 1.0077 1.0031 0.9980 1.0120 1.0117 1.0039 1.0133 0.9898 0.9915 0.9890 2.4364 2.1162 1.9910 2.0122 2.2427 3.7718 3.8414 3.9071 3.9105 3.9076 3.8038 4.0743 3.5499 3.9743 4.1113 3.9580 3.8559 3.7378 3.9340 3.8953 3.6581 3.8005 3.5986 3.9396 3.9089 3.8913 3.9080 3.8912 1.0059 1.0285 0.9993 1.0009 1.0068 1.0020 1.0046 1.0012 1.0066 1.0058 1.0103 1.0070 1.0066 0.9914 1.0077 1.0031 0.9980 1.0120 1.0117 1.0039 1.0133 0.9898 0.9915 0.9890 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 1.2607 0.9922 1.1908 0.8628 1.8332 1.8401 1.0964 1.0491 0.9527 0.9007 0.9322 0.9406 0.9092 0.9577 0.9997 1.0203 1.0097 0.9909 0.9908 0.9937 0.9933 0.9824 0.9938 1.6934 0.9951 0.9593 1.0114 0.9539 0.9867 0.9858 0.9873 0.9872 0.9556 0.9611 1.0000 1.1932 1.6403 1.6394 0.9729 0.9823 0.9517 0.8511 1.0006 1.0076 1.3769 1.3357 1.4350 0.9911 1.4497 0.9813 1.4112 0.9838 1.3985 0.9828 0.9806 0 14 0 15 1 11 1 16 2 11 3 14 4 19 4 20 5 6 5 7 5 8 5 9 6 7 6 10 6 28 7 11 7 29 8 30 8 31 8 32 9 33 9 34 9 35 10 12 10 36 12 13 12 14 13 15 13 37 13 38 15 39 15 40 16 17 16 41 16 42 17 18 17 19 18 20 18 43 19 44 20 21 21 22 21 45 21 46 22 23 22 24 23 25 23 47 24 26 24 48 25 27 25 49 26 27 26 50 27 51 -0.031442299 -1590.125148031002 10.68692 -9.08621 1.60071 -11.16023 10.57540 -0.58483 12.19129 -12.50377 -0.31248 1.73261 4.40394