Orca 4.2.1 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 Cl O O N N N 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 3 3 3 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 5 337.67519999999973 AuxInfo=1/0/N:12,13,11,14,16,20,21,23,24,10,22,18,9,19,17,25,15,8,7,1,6,5,4,3,2/E:(1,2)(6,7)(8,9)/CRV:6.3,7.3,8.3,9.3,11.3,12.3,14.3,15.3,16.3,17.3,21.2,24.1/rA:49nClOO1NNN2CCCCCCCCC3CC3C3C3C3C3C3C3C3C3HHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;s2s4;s4;s2s8;s7;s7;s8;s8;s10;s3s4s5;s14;s16;s5;s5s6;s17;s17;s6s18;s20;s21;s1s23s24;s9;s9;s10;s10;s11;s11;s11;s12;s12;s12;s13;s13;s13;s14;s14;s16;s16;s18;s19;s20;s21;s22;s23;s24;/rC:-4.6699,1.2276,-2.6743;2.5252,1.5539,.5206;1.8485,-2.2729,-1.6012;2.3257,-.5783,-.172;.8803,-2.3299,.4487;.2364,-3.5645,2.1514;2.0071,.3299,.9773;3.2518,.0936,-1.1165;3.6696,1.2765,-.2478;.5058,.5147,1.1968;2.7317,-.0901,2.253;4.4591,-.7561,-1.4818;2.5187,.5976,-2.3591;.1358,1.7737,1.9751;1.7277,-1.7197,-.5288;-1.3574,1.7999,2.3223;-2.2342,1.6704,1.1088;-.4633,-2.5545,.2771;1.2516,-2.9813,1.5829;-2.8678,.4697,.8017;-2.3804,2.7348,.2218;-.8418,-3.2983,1.3511;-3.6199,.3234,-.3554;-3.1271,2.6098,-.9393;-3.7399,1.3981,-1.2204;4.5334,1.0294,.3815;3.9239,2.1581,-.8356;.112,-.3472,1.7367;.0075,.534,.2244;3.7763,-.3417,2.071;2.2623,-.9476,2.7274;2.7062,.7266,2.9743;4.2145,-1.5456,-2.1886;4.9081,-1.2104,-.5979;5.2159,-.1219,-1.9472;1.6826,1.246,-2.0927;3.2053,1.1785,-2.9769;2.1376,-.2171,-2.971;.6988,1.8331,2.9097;.3887,2.666,1.3995;-1.5777,2.7347,2.8436;-1.5807,.9925,3.0242;-1.0143,-2.1511,-.5559;2.2759,-3.017,1.9193;-2.7717,-.3757,1.4726;-1.9026,3.6839,.4354;-1.8314,-3.6544,1.5912;-4.1025,-.6195,-.5758;-3.2286,3.4483,-1.6154; 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 Number of auxiliary basis functions 1491 RIJ-COSX (HFX calculated with COS-X)) on IntName inp HFTyp RHF Charge 0 Mult 1 NEL 192 Dim 1122 ENuc 2468.8746797705 Eh CNVDIIS on DIISMaxIt 12 DIISStart 0.200000 DIISMaxEq 5 DIISBfac 1.050 DIISMaxC 10.000 CNVNR off 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 LIBINT 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 7.031e-06 Time for diagonalization 0.408 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.347 sec Total time needed 0.763 sec 17 8 8 7 7 7 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 1 337.67519999999973 AuxInfo=1/0/N:12,13,11,14,16,20,21,23,24,10,22,18,9,19,17,25,15,8,7,1,6,5,4,3,2/E:(1,2)(6,7)(8,9)/CRV:6.3,7.3,8.3,9.3,11.3,12.3,14.3,15.3,16.3,17.3,21.2,24.1/rA:49nClOO1NNN2CCCCCCCCC3CC3C3C3C3C3C3C3C3C3HHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;s2s4;s4;s2s8;s7;s7;s8;s8;s10;s3s4s5;s14;s16;s5;s5s6;s17;s17;s6s18;s20;s21;s1s23s24;s9;s9;s10;s10;s11;s11;s11;s12;s12;s12;s13;s13;s13;s14;s14;s16;s16;s18;s19;s20;s21;s22;s23;s24;/rC:-4.6699,1.2276,-2.6743;2.5252,1.5539,.5207;1.8485,-2.2729,-1.6012;2.3257,-.5783,-.172;.8803,-2.3299,.4487;.2364,-3.5645,2.1514;2.0071,.3299,.9773;3.2518,.0936,-1.1165;3.6696,1.2765,-.2478;.5058,.5147,1.1968;2.7317,-.0901,2.253;4.4591,-.7561,-1.4818;2.5187,.5976,-2.3591;.1358,1.7737,1.9751;1.7277,-1.7197,-.5288;-1.3574,1.7999,2.3223;-2.2342,1.6704,1.1088;-.4633,-2.5545,.2771;1.2516,-2.9813,1.5829;-2.8678,.4697,.8017;-2.3804,2.7348,.2218;-.8418,-3.2983,1.3511;-3.6199,.3234,-.3554;-3.1271,2.6098,-.9393;-3.7399,1.3981,-1.2204;4.5334,1.0294,.3815;3.9239,2.1581,-.8356;.112,-.3472,1.7367;.0075,.534,.2244;3.7763,-.3417,2.071;2.2623,-.9476,2.7274;2.7062,.7266,2.9743;4.2145,-1.5456,-2.1886;4.9081,-1.2104,-.5979;5.2159,-.1219,-1.9472;1.6826,1.246,-2.0927;3.2053,1.1785,-2.9769;2.1376,-.2171,-2.971;.6988,1.8331,2.9097;.3887,2.666,1.3995;-1.5777,2.7347,2.8436;-1.5807,.9925,3.0242;-1.0143,-2.1511,-.5559;2.2759,-3.017,1.9193;-2.7717,-.3757,1.4726;-1.9026,3.6839,.4354;-1.8314,-3.6544,1.5912;-4.1025,-.6195,-.5758;-3.2286,3.4483,-1.6154; 0 1 wb97x-d3 def2-TZVPP def2/J RIJCOSX GRIDX6 NOFINALGRIDX grid4 nofinalgrid scfconv7 smallprint printgap noloewdin NOSOSCF MaxCore 8000 %output print[P_BondOrder_M] 1 print[P_Mayer] 1 print[P_basis] 2 pal nprocs 8 cpcm smd true smdsolvent "1-OCTANOL" 337.67519999999973 AuxInfo=1/0/N:12,13,11,14,16,20,21,23,24,10,22,18,9,19,17,25,15,8,7,1,6,5,4,3,2/E:(1,2)(6,7)(8,9)/CRV:6.3,7.3,8.3,9.3,11.3,12.3,14.3,15.3,16.3,17.3,21.2,24.1/rA:49nClOO1NNN2CCCCCCCCC3CC3C3C3C3C3C3C3C3C3HHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;s2s4;s4;s2s8;s7;s7;s8;s8;s10;s3s4s5;s14;s16;s5;s5s6;s17;s17;s6s18;s20;s21;s1s23s24;s9;s9;s10;s10;s11;s11;s11;s12;s12;s12;s13;s13;s13;s14;s14;s16;s16;s18;s19;s20;s21;s22;s23;s24;/rC:-4.6699,1.2276,-2.6743;2.5252,1.5539,.5206;1.8485,-2.2729,-1.6012;2.3257,-.5783,-.172;.8803,-2.3299,.4487;.2364,-3.5645,2.1514;2.0071,.3299,.9773;3.2518,.0936,-1.1165;3.6696,1.2765,-.2478;.5058,.5147,1.1968;2.7317,-.0901,2.253;4.4591,-.7561,-1.4818;2.5187,.5976,-2.3591;.1358,1.7737,1.9751;1.7277,-1.7197,-.5288;-1.3574,1.7999,2.3223;-2.2342,1.6704,1.1088;-.4633,-2.5545,.2771;1.2516,-2.9813,1.5829;-2.8678,.4697,.8017;-2.3804,2.7348,.2218;-.8418,-3.2983,1.3511;-3.6199,.3234,-.3554;-3.1271,2.6098,-.9393;-3.7399,1.3981,-1.2204;4.5334,1.0294,.3815;3.9239,2.1581,-.8356;.112,-.3472,1.7367;.0075,.534,.2244;3.7763,-.3417,2.071;2.2623,-.9476,2.7274;2.7062,.7266,2.9743;4.2145,-1.5456,-2.1886;4.9081,-1.2104,-.5979;5.2159,-.1219,-1.9472;1.6826,1.246,-2.0927;3.2053,1.1785,-2.9769;2.1376,-.2171,-2.971;.6988,1.8331,2.9097;.3887,2.666,1.3995;-1.5777,2.7347,2.8436;-1.5807,.9925,3.0242;-1.0143,-2.1511,-.5559;2.2759,-3.017,1.9193;-2.7717,-.3757,1.4726;-1.9026,3.6839,.4354;-1.8314,-3.6544,1.5912;-4.1025,-.6195,-.5758;-3.2286,3.4483,-1.6154; Epsilon 9.8629 Refrac 1.0000 Rsolv 1.3000 Surface type GEPOL SES Epsilon function type CPCM Cl O N C H 2.3800 1.6280 1.8900 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! ( 0.8s) GEPOL surface points 2005 GEPOL Volume 2740.1970 GEPOL Surface-area 1309.1885 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 0.4s) Overall time for CPCM initialization 1.3s -1513.52049675 2468.87467977 -3982.39517652 -6974.62135146 2992.22617495 -0.03085845 -3021.68568716 1508.16519041 2.00355088 96.000038921815 96.000038921815 192.000077843631 -124.307330395907 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 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 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 -2765.2554 -523.9239 -523.0092 -394.3104 -393.7392 -392.2276 -283.8605 -282.6358 -281.3809 -281.3047 -281.1745 -280.9215 -280.4931 -280.0781 -279.9997 -279.9529 -279.9467 -279.8082 -279.8040 -279.5878 -279.5437 -279.5187 -279.3404 -279.2744 -279.2026 -260.5563 -199.3884 -199.1619 -199.1549 -32.9832 -32.4865 -31.1370 -28.8961 -27.6093 -27.4168 -26.2750 -25.7721 -24.8328 -23.9868 -23.7696 -23.6949 -22.9762 -22.0807 -21.9030 -21.5625 -21.4495 -20.3519 -19.9012 -19.6138 -19.4519 -18.8721 -18.4662 -18.3215 -17.5549 -16.7039 -16.6195 -16.0650 -15.9516 -15.8172 -15.6098 -15.4519 -15.2001 -14.9932 -14.8540 -14.7468 -14.6374 -14.3818 -14.3330 -14.1011 -13.9886 -13.9721 -13.8640 -13.7145 -13.5075 -13.2881 -13.1554 -13.0816 -12.8450 -12.7723 -12.3766 -12.1891 -12.1556 -12.0398 -11.6858 -11.5416 -11.4514 -11.2716 -11.1570 -11.0852 -10.4995 -10.1591 -10.0796 -9.6980 -9.5561 -8.9962 -8.8132 1.4473 1.5329 1.8956 2.6209 2.9675 3.1050 3.3362 3.6608 3.7540 3.8015 4.1081 4.1326 4.4037 4.4871 4.6674 4.8020 4.8800 4.8958 5.0506 5.1479 5.2055 5.3615 5.5015 5.6252 5.6442 5.8269 5.9829 6.0051 6.0702 6.0876 6.2544 6.4210 6.4618 6.5588 6.5866 6.8364 6.9891 7.0132 7.2438 7.3357 7.4840 7.5160 7.6764 7.8398 7.9118 8.1061 8.1707 8.2853 8.3110 8.4793 8.5839 8.6544 8.7209 8.7676 8.9234 9.0492 9.1433 9.3013 9.4325 9.5253 9.7068 9.7933 9.8926 10.0176 10.0563 10.3743 10.4219 10.5055 10.6259 10.6813 10.8237 10.8923 11.1469 11.1942 11.2490 11.3247 11.5370 11.5501 11.6136 11.7760 11.8466 11.9286 12.0741 12.1870 12.3038 12.4714 12.5840 12.7082 12.8037 12.8350 12.9972 13.0169 13.1238 13.1686 13.1858 13.4746 13.5154 13.5683 13.7366 13.8001 13.8151 14.0348 14.1074 14.1818 14.3110 14.3489 14.4569 14.4806 14.6760 14.7320 14.8078 14.8904 14.9442 15.0403 15.1043 15.2494 15.2726 15.3259 15.4700 15.5793 15.7128 15.7708 15.9414 15.9649 16.0128 16.2226 16.3743 16.3754 16.5176 16.6177 16.6437 16.6765 16.6981 16.9449 17.1044 17.2236 17.3137 17.4515 17.5647 17.7591 18.0125 18.0720 18.2037 18.3465 18.3773 18.5102 18.5905 18.6690 18.7453 18.9611 19.1477 19.2346 19.4604 19.6155 19.7071 19.7832 20.0484 20.2326 20.2548 20.6066 20.6516 20.7804 20.8325 21.0102 21.3583 21.4987 21.6406 21.8280 21.8937 22.1127 22.2935 22.3546 22.4895 22.5517 22.7901 22.7992 23.1232 23.1364 23.2363 23.3930 23.7012 23.8366 23.9324 23.9774 24.1043 24.1913 24.5177 24.5581 24.6722 24.8990 25.0193 25.1460 25.2986 25.5075 25.7289 25.8728 26.0304 26.1374 26.2151 26.5001 26.6249 26.7298 27.1104 27.1346 27.3092 27.5637 27.6916 27.8183 27.9917 28.1210 28.4760 28.5598 28.6621 28.7206 28.9179 29.0197 29.2225 29.2516 29.3199 29.5152 29.7012 29.8558 30.0103 30.1344 30.3142 30.3952 30.4861 30.6420 30.8533 30.9104 31.1371 31.2019 31.3364 31.4251 31.6093 31.7086 31.8459 31.9624 32.1067 32.2668 32.2872 32.4491 32.4931 32.8838 32.9395 33.0131 33.0808 33.2572 33.5320 33.7373 33.7740 33.8985 34.1706 34.2364 34.3649 34.7402 34.8741 34.9405 35.1180 35.2444 35.3102 35.5294 35.6618 35.7593 36.0782 36.2579 36.4103 36.4684 36.7726 36.8362 36.8930 36.9516 37.0290 37.1238 37.5324 37.5472 37.8424 38.0390 38.0560 38.1213 38.2815 38.4581 38.5878 38.6080 38.8458 38.9342 39.0288 39.1724 39.2873 39.3958 39.6022 39.6854 39.7967 39.8219 40.0165 40.1802 40.3385 40.4812 40.6186 40.6743 40.8271 41.0387 41.3780 41.6225 41.7142 41.7703 41.9423 42.0851 42.1900 42.4329 42.6375 42.6765 42.8059 42.9825 43.0015 43.1529 43.2884 43.4028 43.5804 43.7692 43.8611 43.9569 44.0216 44.2605 44.3653 44.4162 44.6400 44.7371 44.8134 44.9318 44.9846 45.1523 45.2024 45.3489 45.4405 45.6307 45.7717 45.8319 45.9999 46.3378 46.3958 46.5935 46.7428 46.9556 47.0267 47.1064 47.3096 47.4154 47.6819 47.7841 47.9996 48.0703 48.1661 48.3502 48.5991 48.6851 48.9908 49.0705 49.2248 49.4161 49.5302 49.7131 49.9956 50.0505 50.2487 50.4960 50.5776 50.7923 50.8481 50.9779 51.1327 51.2778 51.4608 51.5987 51.8255 51.9883 52.1782 52.3738 52.5932 52.9011 52.9444 53.1372 53.2270 53.3649 53.6766 53.8747 54.0813 54.6197 54.8593 54.9693 55.2472 55.2864 55.6248 55.7162 55.9736 56.2207 56.5630 56.7370 57.0567 57.2419 57.5509 57.7662 58.0559 58.1528 58.3864 58.7286 58.7815 59.1229 59.2028 59.5500 59.6473 59.9463 59.9987 60.0523 60.3211 60.5242 60.7728 61.0190 61.1876 61.5294 61.7737 61.9547 62.2598 62.3147 62.7735 62.9340 63.0846 63.2373 63.4281 63.6645 63.8788 64.0214 64.2741 64.3855 64.6737 64.9195 65.1710 65.3257 65.4276 65.6399 65.9042 66.0528 66.3911 66.4803 66.7592 67.0618 67.1722 67.3604 67.9349 68.1281 68.2230 68.3263 68.4220 68.6780 69.0643 69.2983 69.4454 69.8719 70.1868 70.7812 70.9954 71.2220 71.5583 71.6651 71.7645 72.3373 72.6514 72.9300 73.1699 73.3781 73.5279 73.9666 74.0035 74.2125 74.4153 74.5621 74.8016 75.0429 75.1952 75.5214 75.6795 75.9095 76.3348 76.4149 76.6532 76.8632 77.0637 77.1859 77.2721 77.4896 77.6567 77.7747 78.0123 78.1548 78.2389 78.3964 78.7203 78.8889 79.2110 79.3103 79.3715 79.4231 79.5604 79.6039 79.7051 79.8265 79.8803 79.9812 80.1004 80.4826 80.5794 80.7713 80.8304 81.0918 81.2120 81.4794 81.6256 81.6687 81.9253 82.0506 82.2953 82.3757 82.4708 82.6195 82.6771 82.7692 82.8660 83.1088 83.3077 83.3505 83.6079 83.7894 83.9379 84.0081 84.0274 84.3108 84.4431 84.5588 84.6088 84.8088 84.9813 85.0658 85.2664 85.3777 85.4696 85.5402 85.8392 86.0149 86.2441 86.2670 86.3014 86.5473 86.6535 86.7935 86.9179 87.1371 87.1855 87.2599 87.4298 87.8143 87.9273 88.0167 88.1635 88.2503 88.3460 88.6532 88.7275 88.8653 89.0139 89.0970 89.1613 89.3419 89.6269 89.7688 89.8204 89.9064 89.9921 90.1770 90.3897 90.4407 90.4679 90.6684 90.7849 90.7926 91.0626 91.2650 91.4156 91.5834 91.8636 91.8927 91.9957 92.0197 92.1028 92.2046 92.4833 92.6629 92.7475 92.7721 92.9132 93.0240 93.1873 93.3010 93.4587 93.5054 93.6066 93.8025 93.9298 94.1986 94.2472 94.3446 94.4645 94.5904 94.8660 94.9359 94.9866 95.1135 95.2217 95.3292 95.5931 95.8697 95.9464 95.9949 96.3060 96.4546 96.5048 96.7007 96.8095 97.0224 97.1805 97.3629 97.4724 97.5974 97.6653 97.8850 97.9176 98.0781 98.1016 98.3087 98.5029 98.6174 98.7586 99.0155 99.1512 99.2310 99.3019 99.5193 99.6054 99.6826 99.9846 100.1078 100.1956 100.3876 100.5401 100.6799 100.7770 101.1275 101.2340 101.3665 101.4843 101.6649 101.7199 102.0818 102.3722 102.6581 102.9666 103.1251 103.3455 103.5190 103.6838 103.7854 103.8884 104.0283 104.2919 104.3388 104.4954 104.6590 104.8214 105.0307 105.0466 105.2258 105.3238 105.5909 105.6278 105.8446 105.9402 106.0589 106.1480 106.3927 106.6430 106.6851 106.8042 107.1141 107.2675 107.4361 107.5551 107.7907 107.9750 108.1747 108.2278 108.4058 108.5520 108.5908 108.7791 108.9926 109.0875 109.3647 109.4953 109.7151 109.8544 110.1219 110.1873 110.3865 110.4598 110.8419 110.9886 111.2044 111.3082 111.5806 111.6954 111.8543 112.2039 112.2767 112.3707 112.5690 112.6333 112.8027 112.9927 113.1665 113.3688 113.5783 113.7760 113.8906 114.0239 114.1075 114.4936 114.6917 114.7624 114.9247 114.9588 115.0499 115.1769 115.2731 115.4166 115.5380 115.6298 115.7651 115.9611 116.0349 116.2658 116.3709 116.5034 116.7593 116.8448 116.9345 117.0979 117.1704 117.2503 117.3895 117.5382 117.7060 117.8559 118.1236 118.2287 118.2888 118.5907 118.7782 118.9940 119.0750 119.2240 119.2510 119.4673 119.5272 119.9323 120.1242 120.2820 120.4181 120.5901 120.6577 120.7586 121.0220 121.2055 121.4604 121.6417 121.8416 121.9984 122.1586 122.2472 122.5618 122.6163 122.9344 123.1137 123.3734 123.4920 123.8277 123.9201 124.3311 124.4789 124.6409 124.9821 125.2557 125.6050 126.0033 126.1413 126.7053 126.9098 127.1833 127.2119 127.6160 127.6564 128.1065 128.1328 128.4810 128.9369 129.0486 129.1413 129.4458 129.5462 129.7825 129.9343 130.0997 130.4265 130.6102 130.8233 131.0766 131.1854 131.3250 131.5715 131.8292 131.9579 132.0490 132.1484 132.3492 132.4785 132.6976 132.9215 133.0659 133.1327 133.4807 133.6806 133.8071 133.8822 134.4191 134.5290 134.7540 134.8668 134.9860 135.1149 135.4227 135.5150 135.6804 135.8557 136.0251 136.3787 136.6756 136.9502 137.1969 137.7176 137.8264 138.1864 138.4587 138.4953 138.6843 139.0315 139.1372 139.3427 139.6555 139.9019 139.9821 140.1999 140.3326 140.5224 141.0597 141.4178 141.6899 142.0093 142.1650 142.6059 142.6602 143.0510 143.1694 143.3907 143.5913 143.9846 144.1053 144.2341 144.5529 145.0063 145.0561 145.5393 145.5641 145.6471 145.8084 145.9068 146.1548 146.2895 146.7294 146.7870 147.1272 147.3626 147.5587 147.6957 147.9715 148.1786 148.3822 148.5004 148.6225 148.7971 148.8408 149.2609 149.4822 149.6192 149.7516 150.0643 150.1110 150.4686 150.8212 151.0357 151.4256 151.4692 151.7290 151.8898 152.1135 152.2882 152.6165 152.8931 153.0380 153.2975 153.3628 153.5482 153.9572 154.1908 154.5085 154.7888 154.8280 155.1537 155.6764 156.0343 156.0950 156.3562 156.7269 156.8127 156.9943 157.2377 157.4708 157.5957 157.6234 157.9657 158.2951 158.4830 158.7570 158.8426 159.3709 159.6557 160.3169 160.4560 160.5558 161.0664 161.2785 161.4517 161.9683 162.0261 162.4536 162.6572 163.0601 163.4506 164.3789 165.3523 166.2687 167.5028 168.2361 168.9202 170.2193 170.7240 171.4271 171.8723 172.8122 176.1174 176.7189 177.6758 178.3166 178.8782 179.0551 184.0424 184.9285 189.0230 189.4211 191.2044 194.1455 195.8554 196.6377 198.7689 204.5529 206.3039 221.6562 222.9516 223.4960 227.2873 229.5513 294.8814 297.3857 312.4862 617.1842 626.9264 627.2005 627.5202 631.1733 634.0832 635.0865 637.2399 640.6431 640.8754 641.7226 644.7985 645.3422 647.3736 647.5796 647.6807 650.9211 651.5600 655.7475 711.7178 884.3149 902.6484 909.1562 1201.5503 1216.8664 -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 Cl O O N N N 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 -0.104968 -0.360496 -0.456094 -0.043568 -0.025795 -0.372626 0.197503 0.138625 0.075162 -0.155472 -0.324435 -0.322842 -0.355199 -0.146894 0.365434 -0.099543 0.041817 -0.147068 0.023169 -0.193745 -0.204867 -0.116734 -0.157093 -0.147529 0.099008 0.081751 0.107737 0.078970 0.099289 0.109631 0.117486 0.111505 0.108241 0.099686 0.113159 0.106508 0.105481 0.109017 0.089685 0.080792 0.101493 0.089824 0.176833 0.181142 0.136960 0.139618 0.164347 0.142633 0.142461 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 Cl O O N N N 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 17.1050 8.3605 8.4561 7.0436 7.0258 7.3726 5.8025 5.8614 5.9248 6.1555 6.3244 6.3228 6.3552 6.1469 5.6346 6.0995 5.9582 6.1471 5.9768 6.1937 6.2049 6.1167 6.1571 6.1475 5.9010 0.9182 0.8923 0.9210 0.9007 0.8904 0.8825 0.8885 0.8918 0.9003 0.8868 0.8935 0.8945 0.8910 0.9103 0.9192 0.8985 0.9102 0.8232 0.8189 0.8630 0.8604 0.8357 0.8574 0.8575 17.0000 8.0000 8.0000 7.0000 7.0000 7.0000 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 -0.1050 -0.3605 -0.4561 -0.0436 -0.0258 -0.3726 0.1975 0.1386 0.0752 -0.1555 -0.3244 -0.3228 -0.3552 -0.1469 0.3654 -0.0995 0.0418 -0.1471 0.0232 -0.1937 -0.2049 -0.1167 -0.1571 -0.1475 0.0990 0.0818 0.1077 0.0790 0.0993 0.1096 0.1175 0.1115 0.1082 0.0997 0.1132 0.1065 0.1055 0.1090 0.0897 0.0808 0.1015 0.0898 0.1768 0.1811 0.1370 0.1396 0.1643 0.1426 0.1425 1.2009 1.9703 2.0537 3.1332 3.2522 3.1073 4.1215 3.9205 3.9000 3.8184 3.9695 3.9097 3.9264 3.9011 4.2541 3.8281 3.5612 3.9032 4.0373 3.9208 3.9777 4.0192 3.9792 3.9767 3.8186 1.0027 0.9938 1.0020 1.0091 1.0043 0.9994 1.0074 1.0155 1.0046 0.9994 1.0067 1.0019 1.0185 1.0174 1.0245 1.0066 1.0096 0.9984 0.9880 1.0056 1.0036 1.0020 1.0053 1.0049 1.2009 1.9703 2.0537 3.1332 3.2522 3.1073 4.1215 3.9205 3.9000 3.8184 3.9695 3.9097 3.9264 3.9011 4.2541 3.8281 3.5612 3.9032 4.0373 3.9208 3.9777 4.0192 3.9792 3.9767 3.8186 1.0027 0.9938 1.0020 1.0091 1.0043 0.9994 1.0074 1.0155 1.0046 0.9994 1.0067 1.0019 1.0185 1.0174 1.0245 1.0066 1.0096 0.9984 0.9880 1.0056 1.0036 1.0020 1.0053 1.0049 -0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 0.9951 0.9593 0.9502 1.9212 0.9084 0.9124 1.3182 0.9643 1.0985 1.1867 1.7053 1.3394 0.9144 0.9984 0.9337 0.9423 0.9517 1.0030 0.9723 0.9190 1.0027 0.9958 0.9779 0.9880 0.9821 0.9914 0.9827 0.9848 0.9802 0.9893 0.9934 0.9206 1.0031 1.0202 0.8629 1.0106 1.0288 1.3161 1.3614 1.6747 0.9665 0.9618 1.4413 0.9937 1.4622 0.9912 0.9728 1.3785 0.9848 1.3652 0.9819 0 24 1 6 1 8 2 14 3 6 3 7 3 14 4 14 4 17 4 18 5 18 5 21 6 9 6 10 7 8 7 11 7 12 8 25 8 26 9 13 9 27 9 28 10 29 10 30 10 31 11 32 11 33 11 34 12 35 12 36 12 37 13 15 13 38 13 39 15 16 15 40 15 41 16 19 16 20 17 21 17 42 18 43 19 22 19 44 20 23 20 45 21 46 22 24 22 47 23 24 23 48 -0.030277453 -1513.550774201581 29.11568 -27.38861 1.72707 5.54522 -3.42304 2.12218 12.29035 -11.47929 0.81106 2.85381 7.25382