Orca 5.0.2 RELEASE 1 2 3 4 5 6 14s9p3d1f 11s6p2d1f 11s6p2d1f 11s6p2d1f 11s6p2d1f 5s2p1d 5s5p3d1f 5s3p2d1f 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 Cl F F F F F O O N 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 1 2 2 2 2 2 3 3 4 4 4 4 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 6 6 6 6 6 6 6 6 6 6 6 6 6 6 446.67391599999974 AuxInfo=1/0/N:30,28,29,25,26,18,22,15,16,20,21,14,13,19,31,24,17,23,27,1,2,3,4,5,6,12,11,10,9,8,7/E:(2,3)(4,5)(21,22)(23,24,25)/CRV:1.3,2.3,3.3,4.3,5.3,6.3,7.3,8.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,27.2,28.2,30.1/rA:45nClFFFFFOO1NN2N2NC3C3C3CC3C3C3CC3C3CC3C3C3CC3C3C3C3HHHHHHHHHHHHHH/rB:;;;;;;;;s9;;;s9;;s13s14;s7s14;s9s11;s13;s1s14;s7;s17;s18s19;s2s3s20;s10s11;s21;s21;s4s5s6s23;s25;s26;s28s29;s8s12s24;s15;s16;s16;s18;s20;s20;s22;s25;s26;s28;s29;s30;s12;s12;/rC:1.4445,-4.3498,-1.7597;5.2772,.3986,2.5985;4.0096,1.3389,1.0876;3.0029,-.1053,4.1037;1.8306,1.0066,2.675;3.4552,1.9675,3.7035;2.5508,-.9853,.8501;-3.1654,1.9144,3.1601;-2.0215,.2123,-.4052;-2.1728,.5442,.8775;-3.4585,1.833,-.4188;-4.3991,3.2135,1.7639;-1.1926,-.8805,-.7493;.9046,-2.0284,-.4857;.0699,-.9617,-.1837;2.2772,-2.1404,.1148;-2.7941,1.0071,-1.1882;-1.6521,-1.8587,-1.6156;.4366,-2.9996,-1.3655;3.8034,-.9782,1.4511;-2.8624,.982,-2.6497;-.8248,-2.9212,-1.9304;4.04,.3966,2.0504;-3.045,1.5177,.8278;-4.0954,1.1911,-3.2626;-1.7268,.8053,-3.4377;3.053,.8282,3.1533;-4.1949,1.1994,-4.6438;-1.831,.8175,-4.8185;-3.0642,1.0082,-5.4246;-3.5292,2.2215,2.0505;.3937,-.1944,.5045;2.3284,-3.0385,.7483;3.0201,-2.2805,-.6839;-2.6452,-1.8039,-2.039;3.8944,-1.7411,2.2357;4.611,-1.1602,.7263;-1.1648,-3.6953,-2.6036;-4.9726,1.3472,-2.6491;-.7558,.6758,-2.9782;-5.1575,1.3575,-5.1114;-.9433,.6861,-5.4225;-3.1426,1.0159,-6.5036;-4.6402,3.4296,.8131;-4.7782,3.7666,2.5108; 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 1675 RIJ-COSX (HFX calculated with COS-X)) on IntName inp HFTyp RHF Charge 0 Mult 1 NEL 234 Dim 1168 ENuc 3264.4277377917 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 4.886e-06 Time for diagonalization 0.477 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.234 sec Total time needed 0.717 sec 17 9 9 9 9 9 8 8 7 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 1 446.67391599999974 AuxInfo=1/0/N:30,28,29,25,26,18,22,15,16,20,21,14,13,19,31,24,17,23,27,1,2,3,4,5,6,12,11,10,9,8,7/E:(2,3)(4,5)(21,22)(23,24,25)/CRV:1.3,2.3,3.3,4.3,5.3,6.3,7.3,8.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,27.2,28.2,30.1/rA:45nClFFFFFOO1NN2N2NC3C3C3CC3C3C3CC3C3CC3C3C3CC3C3C3C3HHHHHHHHHHHHHH/rB:;;;;;;;;s9;;;s9;;s13s14;s7s14;s9s11;s13;s1s14;s7;s17;s18s19;s2s3s20;s10s11;s21;s21;s4s5s6s23;s25;s26;s28s29;s8s12s24;s15;s16;s16;s18;s20;s20;s22;s25;s26;s28;s29;s30;s12;s12;/rC:1.4445,-4.3498,-1.7597;5.2772,.3986,2.5985;4.0096,1.3389,1.0876;3.0029,-.1053,4.1037;1.8306,1.0066,2.675;3.4552,1.9675,3.7035;2.5508,-.9853,.8501;-3.1654,1.9144,3.1601;-2.0215,.2123,-.4052;-2.1728,.5442,.8775;-3.4585,1.833,-.4188;-4.3991,3.2135,1.7639;-1.1926,-.8805,-.7493;.9046,-2.0284,-.4857;.0699,-.9617,-.1837;2.2772,-2.1404,.1148;-2.7941,1.0071,-1.1882;-1.6521,-1.8587,-1.6155;.4366,-2.9996,-1.3655;3.8034,-.9782,1.4511;-2.8624,.982,-2.6497;-.8248,-2.9212,-1.9304;4.04,.3966,2.0504;-3.045,1.5177,.8278;-4.0954,1.1911,-3.2626;-1.7268,.8053,-3.4377;3.053,.8282,3.1533;-4.1949,1.1994,-4.6438;-1.831,.8175,-4.8185;-3.0642,1.0082,-5.4246;-3.5292,2.2215,2.0505;.3937,-.1944,.5045;2.3284,-3.0385,.7483;3.0201,-2.2805,-.6839;-2.6452,-1.8039,-2.039;3.8944,-1.7411,2.2357;4.611,-1.1602,.7263;-1.1648,-3.6953,-2.6036;-4.9726,1.3472,-2.6491;-.7558,.6758,-2.9782;-5.1575,1.3575,-5.1114;-.9433,.6861,-5.4225;-3.1426,1.0159,-6.5036;-4.6402,3.4296,.8131;-4.7782,3.7666,2.5108; 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 4 446.67391599999974 AuxInfo=1/0/N:30,28,29,25,26,18,22,15,16,20,21,14,13,19,31,24,17,23,27,1,2,3,4,5,6,12,11,10,9,8,7/E:(2,3)(4,5)(21,22)(23,24,25)/CRV:1.3,2.3,3.3,4.3,5.3,6.3,7.3,8.3,11.3,12.3,13.3,14.3,15.3,16.3,17.3,27.2,28.2,30.1/rA:45nClFFFFFOO1NN2N2NC3C3C3CC3C3C3CC3C3CC3C3C3CC3C3C3C3HHHHHHHHHHHHHH/rB:;;;;;;;;s9;;;s9;;s13s14;s7s14;s9s11;s13;s1s14;s7;s17;s18s19;s2s3s20;s10s11;s21;s21;s4s5s6s23;s25;s26;s28s29;s8s12s24;s15;s16;s16;s18;s20;s20;s22;s25;s26;s28;s29;s30;s12;s12;/rC:1.4445,-4.3498,-1.7597;5.2772,.3986,2.5985;4.0096,1.3389,1.0876;3.0029,-.1053,4.1037;1.8306,1.0066,2.675;3.4552,1.9675,3.7035;2.5508,-.9853,.8501;-3.1654,1.9144,3.1601;-2.0215,.2123,-.4052;-2.1728,.5442,.8775;-3.4585,1.833,-.4188;-4.3991,3.2135,1.7639;-1.1926,-.8805,-.7493;.9046,-2.0284,-.4857;.0699,-.9617,-.1837;2.2772,-2.1404,.1148;-2.7941,1.0071,-1.1882;-1.6521,-1.8587,-1.6156;.4366,-2.9996,-1.3655;3.8034,-.9782,1.4511;-2.8624,.982,-2.6497;-.8248,-2.9212,-1.9304;4.04,.3966,2.0504;-3.045,1.5177,.8278;-4.0954,1.1911,-3.2626;-1.7268,.8053,-3.4377;3.053,.8282,3.1533;-4.1949,1.1994,-4.6438;-1.831,.8175,-4.8185;-3.0642,1.0082,-5.4246;-3.5292,2.2215,2.0505;.3937,-.1944,.5045;2.3284,-3.0385,.7483;3.0201,-2.2805,-.6839;-2.6452,-1.8039,-2.039;3.8944,-1.7411,2.2357;4.611,-1.1602,.7263;-1.1648,-3.6953,-2.6036;-4.9726,1.3472,-2.6491;-.7558,.6758,-2.9782;-5.1575,1.3575,-5.1114;-.9433,.6861,-5.4225;-3.1426,1.0159,-6.5036;-4.6402,3.4296,.8131;-4.7782,3.7666,2.5108; -2061.54284569 3264.42773779 -5325.97058348 -9326.61398953 4000.64340605 -4116.47317723 2054.93033154 2.00321788 116.999957326841 116.999957326841 233.999914653681 -164.589757886404 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 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 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 -2765.7355 -675.7552 -675.6590 -675.6506 -675.5139 -675.4398 -524.5297 -522.1329 -395.4180 -393.4473 -392.8142 -392.6145 -286.9187 -285.1986 -282.4556 -282.1484 -282.1383 -282.0212 -281.9154 -281.6655 -281.2570 -280.9554 -280.7375 -280.6362 -280.6116 -280.4731 -280.3725 -280.3021 -280.2764 -280.2488 -280.2313 -261.0070 -199.8422 -199.6074 -199.5983 -39.6578 -38.2791 -37.1082 -37.0244 -36.5984 -33.4989 -32.8668 -31.3799 -28.8906 -28.2590 -27.7707 -27.5627 -26.8593 -26.2252 -25.7336 -24.8124 -24.3698 -24.1101 -23.7891 -23.3914 -22.2866 -21.5791 -21.2313 -21.2203 -20.4384 -20.2874 -19.9287 -19.8508 -19.6888 -19.5529 -19.1654 -18.6773 -18.6019 -18.4442 -17.9096 -17.5284 -17.3935 -17.1817 -17.0010 -16.6668 -16.6035 -16.1770 -16.0590 -16.0100 -15.9379 -15.8886 -15.5613 -15.4635 -15.4413 -15.3254 -15.2130 -15.1175 -14.8633 -14.8154 -14.7168 -14.6771 -14.4504 -14.3042 -14.2532 -14.1219 -13.9637 -13.8229 -13.7161 -13.5286 -13.1429 -12.9117 -12.8106 -12.6058 -12.4673 -12.1945 -12.0039 -11.6162 -11.2582 -10.8634 -10.8398 -10.5617 -10.0600 -9.9367 -9.7971 -9.6409 -9.5028 -8.9465 0.2715 0.8349 0.9786 1.3736 1.6244 2.6076 2.7788 3.0363 3.2131 3.5109 3.6841 3.7407 3.8965 4.0423 4.1417 4.2649 4.6282 4.7212 4.7303 4.8438 5.0634 5.1369 5.2181 5.3624 5.5923 5.6176 5.6930 5.8227 5.9102 6.0224 6.2144 6.3301 6.4211 6.8465 6.9373 7.0150 7.1950 7.2537 7.4620 7.5162 7.6839 7.7078 7.8935 7.9319 8.0918 8.1404 8.2669 8.2892 8.3683 8.4558 8.5495 8.6596 8.7300 8.8383 9.0313 9.0948 9.1404 9.2039 9.2662 9.3250 9.4342 9.4635 9.5620 9.7175 9.7768 9.9906 10.1041 10.1883 10.2727 10.4473 10.5243 10.6470 10.8568 10.8807 11.0034 11.0915 11.2058 11.2305 11.3604 11.4511 11.5060 11.6011 11.7178 11.7381 11.8337 12.0276 12.1277 12.1513 12.2941 12.3635 12.5040 12.6651 12.7091 12.7694 12.8079 12.8967 12.9169 13.0254 13.2362 13.3244 13.3729 13.4922 13.5769 13.7770 13.9729 14.0565 14.1204 14.1468 14.2696 14.3254 14.5052 14.5764 14.6637 14.6836 14.8302 14.9683 15.0273 15.0605 15.3777 15.4527 15.5905 15.6071 15.7061 15.7518 15.9277 16.0081 16.1487 16.2377 16.3035 16.3996 16.5650 16.6364 16.7223 16.9266 16.9920 17.1510 17.1782 17.6111 17.6336 17.8050 17.8392 17.9033 18.0553 18.3677 18.6101 18.8112 18.9049 19.0835 19.1824 19.2966 19.5009 19.5988 19.6719 19.7602 19.8832 20.0636 20.1436 20.2258 20.4167 20.5017 20.6594 20.8164 20.9283 21.1280 21.1981 21.2652 21.3658 21.4873 21.5712 21.6744 21.7887 21.8824 22.0080 22.1564 22.2815 22.4583 22.4914 22.6234 22.6373 22.7381 22.8913 23.0620 23.0750 23.2752 23.3955 23.4448 23.4726 23.6145 23.8438 23.8986 24.1692 24.2827 24.3808 24.5820 24.6135 24.6861 24.8449 25.0191 25.0610 25.2665 25.2890 25.4720 25.6467 25.7350 25.7419 25.9482 26.0602 26.1973 26.2065 26.4591 26.6059 26.8703 26.9396 27.1240 27.2604 27.4548 27.4898 27.6322 27.6675 27.9128 28.0545 28.2148 28.2910 28.3930 28.6115 28.7892 28.8467 29.0564 29.1082 29.3063 29.4533 29.5522 29.6692 29.7300 30.0550 30.0877 30.2766 30.4389 30.4989 30.8170 30.8954 31.2154 31.3200 31.4625 31.6072 31.7121 31.8088 32.0876 32.1494 32.2360 32.4426 32.5211 32.7253 32.8309 32.9335 33.0916 33.2285 33.4954 33.5954 33.8332 33.8735 34.1052 34.4078 34.4686 34.5647 34.7144 34.7219 35.1013 35.2502 35.2991 35.5141 35.8030 35.8270 35.8486 36.0543 36.3930 36.6011 36.8792 36.9405 37.0755 37.2466 37.4546 37.5523 37.6386 37.8292 37.8842 38.0178 38.1905 38.2966 38.4240 38.7216 38.8353 38.9008 39.0144 39.2063 39.2658 39.4566 39.5846 39.7808 39.8272 39.9034 40.0786 40.1688 40.3145 40.5605 40.6569 40.8010 40.9668 41.0964 41.2693 41.4596 41.6951 41.7897 42.0376 42.1101 42.3932 42.4841 42.6560 42.8366 43.0415 43.0533 43.1945 43.3841 43.4148 43.6588 43.9018 44.2724 44.4463 44.5534 44.7581 44.9889 45.1471 45.2896 45.4244 45.6895 45.7938 45.8818 46.2377 46.4773 46.5772 46.7446 47.0810 47.2315 47.3882 47.6164 47.8447 47.9290 48.1211 48.1505 48.2139 48.4097 48.7386 48.9247 49.1343 49.1874 49.5992 49.6875 49.8706 49.9832 50.0592 50.3535 50.4992 50.7407 50.8743 51.0294 51.1748 51.3427 51.4724 51.5244 51.8539 51.9583 52.2376 52.4130 52.6136 52.9407 53.1124 53.4163 53.5060 53.6521 53.6868 53.9377 54.0958 54.3068 54.4767 54.8291 54.9469 55.1248 55.3503 55.4448 55.6367 55.6781 55.7790 55.9498 56.0947 56.3252 56.6551 56.8206 56.8740 57.1783 57.4323 57.4976 57.6348 57.7147 58.0512 58.3342 58.5940 58.6309 58.8406 59.1109 59.1949 59.3094 59.3279 59.8247 59.8897 60.1322 60.1715 60.3810 60.6091 60.7497 61.0560 61.2674 61.3240 61.4264 61.6294 62.0677 62.1297 62.2310 62.4298 62.6175 62.8459 62.9705 63.3479 63.5956 63.8047 63.9973 64.1287 64.4389 64.5554 64.7291 64.9437 65.0344 65.1556 65.4449 65.5885 65.8409 66.0157 66.1518 66.3746 66.5026 66.8218 66.8588 66.9643 67.0197 67.1811 67.7883 68.0527 68.0695 68.2119 68.3884 68.6409 68.8676 68.9463 69.2364 69.3198 69.5321 69.8889 70.0240 70.5266 70.7561 70.8622 71.1138 71.2761 71.9613 72.1148 72.1983 72.3763 72.5207 72.7028 73.3691 73.4201 73.8252 74.2789 74.3645 74.7327 74.9058 75.0389 75.2175 75.4108 75.6588 75.7425 76.0442 76.1978 76.3285 76.5150 76.6830 77.1051 77.1231 77.3877 77.4712 77.6182 77.8115 77.9862 78.1783 78.2943 78.4835 78.7333 78.7806 78.8881 79.0956 79.1449 79.3094 79.4027 79.6490 79.7820 79.9115 80.0193 80.1759 80.4997 80.6554 80.9888 81.0444 81.2280 81.3730 81.6523 81.7004 82.0047 82.2069 82.2336 82.3613 82.4964 82.7326 83.0076 83.0306 83.1806 83.2703 83.4202 83.5883 83.7285 83.7660 83.8931 83.9863 84.1301 84.1646 84.4014 84.4822 84.5279 84.6865 84.7959 84.8997 84.9572 84.9874 85.1739 85.2713 85.4425 85.5490 85.7094 85.9106 85.9634 85.9846 86.1648 86.2597 86.4253 86.5492 86.7098 86.8147 86.9089 87.1498 87.2285 87.3103 87.5441 87.6126 87.8010 87.9193 88.1374 88.1592 88.2193 88.3541 88.4991 88.5362 88.6334 88.6740 88.7168 88.9778 89.2101 89.3554 89.4813 89.5461 89.6987 89.8824 90.0452 90.1743 90.3320 90.4704 90.6798 90.8967 91.0065 91.0384 91.1418 91.4246 91.6439 91.7060 91.8337 92.0755 92.1970 92.3961 92.4405 92.5618 92.6704 92.8316 93.0438 93.0778 93.1931 93.5230 93.5771 93.6274 93.8233 93.8551 94.0973 94.2948 94.3616 94.5374 94.5892 94.8231 95.1370 95.2313 95.3840 95.5061 95.6776 95.8097 95.9853 96.1877 96.2586 96.4425 96.5492 96.7833 96.9438 96.9858 97.1082 97.2543 97.3912 97.6749 97.7101 97.7950 98.0853 98.2241 98.3140 98.5122 98.7307 98.8272 99.0029 99.1198 99.2874 99.5740 99.7647 99.8046 99.9999 100.1431 100.2765 100.5463 100.7392 100.9278 101.2627 101.4167 101.4352 101.7953 102.0744 102.2138 102.3267 102.4998 102.6060 102.7127 102.7798 103.1865 103.4059 103.4423 103.6611 103.9213 104.2578 104.4062 104.4900 104.6531 104.6874 104.8786 104.9837 105.1254 105.2750 105.4320 105.6649 105.8417 105.9443 106.0499 106.1978 106.3969 106.4579 106.6086 106.7114 106.8709 107.0198 107.1768 107.3577 107.6649 107.7885 107.9197 108.2667 108.3277 108.5540 108.7483 108.8587 108.9872 109.1183 109.2400 109.3382 109.4860 109.5506 109.7358 109.8165 110.1446 110.1988 110.4999 110.5739 110.6760 110.8877 111.0976 111.4679 111.6127 111.6917 111.8355 112.1069 112.3148 112.4280 112.6510 112.9485 113.0775 113.1758 113.5212 113.7128 113.8291 113.8959 113.9538 114.1735 114.3790 114.6026 114.6894 114.7239 114.9411 115.1858 115.3283 115.4858 115.5949 115.8976 116.0328 116.1318 116.4385 116.6162 116.8193 117.0495 117.1286 117.3640 117.4692 117.5918 117.6870 117.9357 118.2814 118.3929 118.4640 118.6295 118.8377 118.9190 119.1435 119.2327 119.3878 119.5174 119.7631 119.9546 120.1035 120.4764 120.5014 120.9864 121.2231 121.4526 121.5521 121.8867 122.4541 122.6033 122.7717 122.9115 123.4246 123.6657 123.8585 124.0901 124.4443 124.9170 125.3262 125.5117 125.7231 126.1046 126.4722 126.8090 127.2384 127.5343 127.5897 128.2117 128.6211 128.7570 128.8994 128.9976 129.2176 129.4291 129.9115 129.9514 130.3542 130.5186 130.6450 130.8130 131.0331 131.3359 131.5635 131.8664 132.2334 132.4646 132.7455 132.7843 132.8925 133.1066 133.5174 133.7406 134.0905 134.3370 134.7118 134.9427 135.0366 135.0894 135.5178 135.9126 136.0201 136.1869 136.5191 136.6770 137.1971 137.3739 138.1069 138.2515 138.3569 138.4341 138.6264 139.0560 139.5029 140.0421 140.0780 140.7802 140.8400 141.5737 141.7227 141.9219 142.3855 142.5672 142.7846 143.0469 143.4460 143.6144 143.9308 143.9847 144.3205 144.5328 144.8632 145.2769 145.5618 145.9879 146.0926 146.4551 146.8799 147.1871 147.3507 147.4539 148.0111 148.1626 148.3817 148.4637 148.6096 148.8659 149.0543 149.2936 149.4837 149.8082 149.9267 150.2543 150.5535 150.8039 151.2434 151.3840 151.7686 152.3730 152.7423 153.0882 153.4181 153.8167 154.2393 154.3621 154.8587 155.2074 155.3994 156.0367 156.5676 156.8429 157.0162 157.0969 157.6218 157.9658 158.2698 158.6411 159.0433 159.7755 160.5188 160.5431 161.0419 161.5442 162.5058 163.5550 164.5699 164.8878 166.2918 166.6906 167.0523 168.0912 168.3755 169.1821 170.6913 171.1519 171.8708 172.4432 172.8197 174.8004 175.1064 175.9731 177.3323 177.5378 180.7249 181.4078 183.2985 183.8075 184.8092 186.4357 187.2230 188.0587 188.3389 188.4166 188.4868 188.5527 188.6178 188.6652 188.7267 188.8830 188.9723 189.0903 189.1447 189.3040 189.4653 189.5077 189.7925 190.2585 191.8338 192.4830 192.9327 193.0400 193.4930 193.5206 194.1159 194.4090 194.8696 195.1760 196.3726 196.6641 197.8006 199.2364 199.3964 201.9417 202.2910 202.5117 203.5702 203.8185 204.0996 204.3831 205.2355 207.6850 208.8735 209.9583 210.2507 221.6213 223.3962 223.9535 227.6028 227.7010 228.0122 228.0835 228.6718 229.8216 230.1340 231.0881 232.6646 233.0177 233.8437 235.2465 238.6936 239.9260 240.9633 242.5980 243.6847 244.2225 245.3555 245.8303 246.5850 247.1066 247.7215 248.6101 248.8069 250.5914 250.9458 294.7695 298.3201 312.9021 614.5112 618.7482 622.1221 624.7809 628.7312 632.0031 633.2144 634.2020 634.6046 635.3897 636.0439 636.6700 636.9083 638.1938 641.2485 643.1491 647.9330 653.9345 660.2726 714.6003 882.5322 888.9811 895.5637 904.1871 1199.7072 1211.9304 1558.8351 1559.1048 1561.2370 1563.1725 1566.1114 -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 Cl F F F F F O O N 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 -0.065355 -0.175643 -0.170589 -0.161560 -0.137716 -0.148570 -0.296312 -0.346686 0.170104 -0.268672 -0.390743 -0.246584 -0.010612 0.022552 -0.082100 0.025424 0.406740 -0.150597 0.021275 -0.054131 -0.158134 -0.102120 0.325079 0.259239 -0.139827 -0.169677 0.450615 -0.156260 -0.135385 -0.089202 0.201491 0.147265 0.094803 0.089146 0.140792 0.106067 0.095792 0.123292 0.124454 0.135494 0.129002 0.129165 0.131221 0.167546 0.159918 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 Cl F F F F F O O N 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 17.0654 9.1756 9.1706 9.1616 9.1377 9.1486 8.2963 8.3467 6.8299 7.2687 7.3907 7.2466 6.0106 5.9774 6.0821 5.9746 5.5933 6.1506 5.9787 6.0541 6.1581 6.1021 5.6749 5.7408 6.1398 6.1697 5.5494 6.1563 6.1354 6.0892 5.7985 0.8527 0.9052 0.9109 0.8592 0.8939 0.9042 0.8767 0.8755 0.8645 0.8710 0.8708 0.8688 0.8325 0.8401 17.0000 9.0000 9.0000 9.0000 9.0000 9.0000 8.0000 8.0000 7.0000 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 -0.0654 -0.1756 -0.1706 -0.1616 -0.1377 -0.1486 -0.2963 -0.3467 0.1701 -0.2687 -0.3907 -0.2466 -0.0106 0.0226 -0.0821 0.0254 0.4067 -0.1506 0.0213 -0.0541 -0.1581 -0.1021 0.3251 0.2592 -0.1398 -0.1697 0.4506 -0.1563 -0.1354 -0.0892 0.2015 0.1473 0.0948 0.0891 0.1408 0.1061 0.0958 0.1233 0.1245 0.1355 0.1290 0.1292 0.1312 0.1675 0.1599 1.2692 1.1345 1.1462 1.1564 1.1775 1.1715 2.0174 2.1855 3.3108 2.8959 3.0519 3.1574 3.8372 3.6833 4.0011 3.9778 3.6662 4.0108 4.0193 3.9676 3.5949 4.0221 4.2825 3.7067 4.0081 3.9334 4.4441 3.9977 3.9746 3.9343 4.4134 1.0345 0.9858 0.9917 0.9970 1.0063 1.0055 1.0129 1.0293 1.0067 1.0033 1.0029 0.9987 1.0385 1.0266 1.2692 1.1345 1.1462 1.1564 1.1775 1.1715 2.0174 2.1855 3.3108 2.8959 3.0519 3.1574 3.8372 3.6833 4.0011 3.9778 3.6662 4.0108 4.0193 3.9676 3.5949 4.0221 4.2825 3.7067 4.0081 3.9334 4.4441 3.9977 3.9746 3.9343 4.4134 1.0345 0.9858 0.9917 0.9970 1.0063 1.0055 1.0129 1.0293 1.0067 1.0033 1.0029 0.9987 1.0385 1.0266 -0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 1.1190 1.0852 1.1189 1.1206 1.1538 1.1511 0.9944 0.9875 2.1566 1.0130 0.9646 1.2598 0.1019 1.6229 1.6016 1.2708 1.2744 0.9628 0.9697 1.4279 1.3547 1.4044 0.9530 1.3384 0.9546 0.9660 0.9767 0.7986 1.4615 0.9834 1.4303 0.9967 0.9573 0.9695 1.4074 1.3228 0.9619 0.9628 0.8923 1.4837 0.9697 1.4767 0.9856 1.4244 0.9766 1.4242 0.9751 0.9728 0 18 1 22 2 22 3 26 4 26 5 26 6 15 6 19 7 30 8 9 8 12 8 16 9 16 9 23 10 16 10 23 11 30 11 43 11 44 12 14 12 17 13 14 13 15 13 18 14 31 15 32 15 33 16 20 17 21 17 34 18 21 19 22 19 35 19 36 20 24 20 25 21 37 22 26 23 30 24 27 24 38 25 28 25 39 27 29 27 40 28 29 28 41 29 42 -0.022120433 -2061.564966119200 -31.34910 31.19250 -0.15660 0.17225 -0.97225 -0.79999 -30.04501 27.46773 -2.57728 2.70313 6.87081