Orca 5.0.2 RELEASE 1 2 3 4 11s6p2d1f 11s6p2d1f 11s6p2d1f 5s2p1d 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 O O O O 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 H 1 1 1 1 2 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 4 306.2075999999998 AuxInfo=1/0/N:15,16,9,10,21,22,19,20,11,14,13,17,18,7,8,23,24,12,6,5,3,4,2,1/E:(1,2)(3,4)(5,6)(7,8)(12,13)(16,17)(21,22)/CRV:9.3,11.3,12.3,13.3,16.3,17.3,18.3,21.1,22.1,23.1/rA:49nOO1O1O1NCCCCCC3C3C3CCCC3C3CCCCC3C3HHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;s6;s6s7;s6;s6;s7;s1s2s8;s11;s1s5;s13;s13;;s17;s17;s18;s19;s20s21;s3s5s17;s4s5s18;s7;s8;s9;s9;s9;s10;s10;s10;s11;s14;s14;s15;s15;s15;s16;s16;s16;s19;s19;s20;s20;s21;s21;s22;s22;/rC:.6018,1.3963,-1.4942;.2304,-.8047,-1.3141;-2.743,-.4779,-2.1055;-1.1163,2.8359,.5479;-1.7222,1.3274,-1.0869;2.2631,-.0489,1.0966;2.7725,-1.1184,.185;2.2302,.1572,-.4121;.9774,-.2898,1.8514;3.2397,.8211,1.8478;4.2153,-1.452,.0658;.938,.1545,-1.1166;4.7567,-2.11,-.9627;-.6929,1.6165,-2.0376;6.2145,-2.4542,-.9914;3.9713,-2.5559,-2.1576;-3.2241,.1256,.1856;-2.7598,1.1066,.9609;-4.2171,-.8934,.6029;-3.1685,1.3533,2.3646;-4.3498,-.8771,2.127;-4.4297,.5465,2.6775;-2.5719,.2248,-1.1422;-1.7723,1.8914,.1832;2.0999,-1.9658,.0796;2.9471,.8799,-.787;.4589,.6505,2.0516;1.1977,-.753,2.8151;.2888,-.9509,1.3268;3.543,.344,2.7818;2.7781,1.7772,2.1009;4.1407,1.0344,1.2729;4.8605,-1.1624,.8901;-.8645,1.0212,-2.9337;-.706,2.6683,-2.3093;6.702,-2.0232,-1.8696;6.3597,-3.5354,-1.0582;6.7386,-2.0981,-.1046;4.0068,-3.6437,-2.2601;4.4045,-2.1482,-3.0745;2.9249,-2.2568,-2.1226;-5.1793,-.6775,.1274;-3.9193,-1.8824,.2469;-2.3477,1.0666,3.0304;-3.3341,2.42,2.5323;-5.2346,-1.442,2.4217;-3.4892,-1.3878,2.5677;-4.5885,.522,3.7559;-5.2962,1.0526,2.2436; 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 1451 RIJ-COSX (HFX calculated with COS-X)) on IntName inp HFTyp RHF Charge 0 Mult 1 NEL 178 Dim 1094 ENuc 2159.4315859232 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 1.180e-05 Time for diagonalization 0.276 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.250 sec Total time needed 0.533 sec 8 8 8 8 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 1 306.2075999999998 AuxInfo=1/0/N:15,16,9,10,21,22,19,20,11,14,13,17,18,7,8,23,24,12,6,5,3,4,2,1/E:(1,2)(3,4)(5,6)(7,8)(12,13)(16,17)(21,22)/CRV:9.3,11.3,12.3,13.3,16.3,17.3,18.3,21.1,22.1,23.1/rA:49nOO1O1O1NCCCCCC3C3C3CCCC3C3CCCCC3C3HHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;s6;s6s7;s6;s6;s7;s1s2s8;s11;s1s5;s13;s13;;s17;s17;s18;s19;s20s21;s3s5s17;s4s5s18;s7;s8;s9;s9;s9;s10;s10;s10;s11;s14;s14;s15;s15;s15;s16;s16;s16;s19;s19;s20;s20;s21;s21;s22;s22;/rC:.6018,1.3963,-1.4942;.2304,-.8047,-1.3141;-2.743,-.4779,-2.1055;-1.1163,2.8359,.5479;-1.7222,1.3274,-1.0869;2.2631,-.0489,1.0966;2.7725,-1.1184,.185;2.2302,.1572,-.4121;.9774,-.2898,1.8514;3.2397,.8211,1.8478;4.2153,-1.452,.0658;.938,.1545,-1.1166;4.7567,-2.11,-.9627;-.6929,1.6165,-2.0376;6.2145,-2.4542,-.9914;3.9713,-2.5559,-2.1576;-3.2241,.1256,.1856;-2.7598,1.1066,.9609;-4.2171,-.8934,.6029;-3.1685,1.3533,2.3646;-4.3498,-.8771,2.127;-4.4297,.5465,2.6775;-2.5719,.2248,-1.1422;-1.7723,1.8914,.1832;2.0999,-1.9658,.0797;2.9471,.8799,-.787;.4589,.6505,2.0516;1.1977,-.753,2.8151;.2888,-.9509,1.3268;3.543,.344,2.7818;2.7781,1.7772,2.1009;4.1407,1.0344,1.2729;4.8605,-1.1624,.8901;-.8645,1.0212,-2.9337;-.706,2.6683,-2.3093;6.702,-2.0232,-1.8696;6.3597,-3.5354,-1.0582;6.7386,-2.0981,-.1046;4.0068,-3.6437,-2.2601;4.4045,-2.1482,-3.0745;2.9249,-2.2568,-2.1226;-5.1793,-.6775,.1274;-3.9193,-1.8824,.2469;-2.3477,1.0666,3.0304;-3.3341,2.42,2.5323;-5.2346,-1.442,2.4217;-3.4892,-1.3878,2.5677;-4.5885,.522,3.756;-5.2962,1.0526,2.2436; 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" 306.2075999999998 AuxInfo=1/0/N:15,16,9,10,21,22,19,20,11,14,13,17,18,7,8,23,24,12,6,5,3,4,2,1/E:(1,2)(3,4)(5,6)(7,8)(12,13)(16,17)(21,22)/CRV:9.3,11.3,12.3,13.3,16.3,17.3,18.3,21.1,22.1,23.1/rA:49nOO1O1O1NCCCCCC3C3C3CCCC3C3CCCCC3C3HHHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;s6;s6s7;s6;s6;s7;s1s2s8;s11;s1s5;s13;s13;;s17;s17;s18;s19;s20s21;s3s5s17;s4s5s18;s7;s8;s9;s9;s9;s10;s10;s10;s11;s14;s14;s15;s15;s15;s16;s16;s16;s19;s19;s20;s20;s21;s21;s22;s22;/rC:.6018,1.3963,-1.4942;.2304,-.8047,-1.3141;-2.743,-.4779,-2.1055;-1.1163,2.8359,.5479;-1.7222,1.3274,-1.0869;2.2631,-.0489,1.0966;2.7725,-1.1184,.185;2.2302,.1572,-.4121;.9774,-.2898,1.8514;3.2397,.8211,1.8478;4.2153,-1.452,.0658;.938,.1545,-1.1166;4.7567,-2.11,-.9627;-.6929,1.6165,-2.0376;6.2145,-2.4542,-.9914;3.9713,-2.5559,-2.1576;-3.2241,.1256,.1856;-2.7598,1.1066,.9609;-4.2171,-.8934,.6029;-3.1685,1.3533,2.3646;-4.3498,-.8771,2.127;-4.4297,.5465,2.6775;-2.5719,.2248,-1.1422;-1.7723,1.8914,.1832;2.0999,-1.9658,.0796;2.9471,.8799,-.787;.4589,.6505,2.0516;1.1977,-.753,2.8151;.2888,-.9509,1.3268;3.543,.344,2.7818;2.7781,1.7772,2.1009;4.1407,1.0344,1.2729;4.8605,-1.1624,.8901;-.8645,1.0212,-2.9337;-.706,2.6683,-2.3093;6.702,-2.0232,-1.8696;6.3597,-3.5354,-1.0582;6.7386,-2.0981,-.1046;4.0068,-3.6437,-2.2601;4.4045,-2.1482,-3.0745;2.9249,-2.2568,-2.1226;-5.1793,-.6775,.1274;-3.9193,-1.8824,.2469;-2.3477,1.0666,3.0304;-3.3341,2.42,2.5323;-5.2346,-1.442,2.4217;-3.4892,-1.3878,2.5677;-4.5885,.522,3.7559;-5.2962,1.0526,2.2436; Epsilon 78.3550 Refrac 1.3328 Rsolv 1.3000 Surface type GAUSSIAN VDW Epsilon function type CPCM O N C H 1.5200 1.8900 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 2889 GEPOL Volume 2257.9004 GEPOL Surface-area 1339.4727 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 0.5s) Overall time for CPCM initialization 0.6s -1094.86733838 2159.43158592 -3254.29892430 -5781.44070125 2527.14177695 -0.03855726 -2184.90675283 1090.03941446 2.00442913 88.999974238800 88.999974238800 177.999948477600 -105.973458233338 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 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 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 -524.9130 -523.6514 -523.6292 -523.2908 -393.9440 -283.5405 -283.3693 -283.3661 -282.4103 -280.4591 -280.4350 -280.3117 -279.9651 -279.8381 -279.7349 -279.7311 -279.7278 -279.4154 -279.4097 -279.2362 -279.1798 -279.1690 -279.1340 -279.1299 -33.9551 -32.8910 -32.4148 -31.3646 -29.7513 -27.3848 -26.7904 -25.1518 -24.8627 -23.8509 -23.4696 -22.9946 -22.0624 -21.7872 -21.7360 -21.3157 -20.9961 -20.0870 -19.7493 -18.9234 -18.1640 -18.0239 -17.6063 -17.2040 -17.0656 -16.6194 -16.4761 -16.2059 -16.0259 -15.5244 -15.3627 -15.3058 -15.1102 -15.0314 -14.6231 -14.5419 -14.4613 -14.3436 -14.1454 -13.9713 -13.9410 -13.7747 -13.5391 -13.5085 -13.1781 -13.0500 -12.8964 -12.8582 -12.8128 -12.4192 -12.2867 -12.0408 -11.8703 -11.6135 -11.4885 -11.4336 -11.3931 -11.0066 -10.8779 -10.7383 -10.4921 -10.2761 -9.9310 -9.5993 -8.6236 -0.4440 1.8882 2.6575 2.9408 3.1675 3.4082 3.7351 3.9709 4.1457 4.1731 4.2607 4.3748 4.4664 4.6784 4.8168 4.8959 5.0398 5.0814 5.1306 5.3488 5.4383 5.5416 5.6291 5.6464 5.7754 5.8244 5.9969 6.1216 6.1792 6.3079 6.4795 6.5407 6.6887 6.7814 6.7976 6.8864 6.9782 7.1678 7.1795 7.4080 7.4865 7.5653 7.6094 7.7044 7.7771 7.9115 8.0075 8.0761 8.1366 8.3781 8.5046 8.7858 8.9185 8.9717 9.2069 9.3882 9.4750 9.5331 9.5468 9.8206 9.9681 9.9996 10.2666 10.3342 10.3921 10.5188 10.6195 10.6981 10.8259 10.8955 10.9460 11.0539 11.1641 11.3566 11.3740 11.7151 11.8282 11.9812 12.1489 12.2061 12.2933 12.4910 12.5562 12.7106 12.8217 12.9742 13.1126 13.1754 13.3146 13.3858 13.4556 13.5280 13.6362 13.7030 13.9156 13.9675 14.0332 14.0888 14.2020 14.2301 14.3850 14.3989 14.4657 14.5424 14.6311 14.6978 14.7899 14.8776 14.9192 15.0896 15.1433 15.2034 15.2952 15.3672 15.3948 15.5010 15.5722 15.5870 15.7211 15.7862 15.7945 15.9200 16.1110 16.1843 16.3020 16.5160 16.6646 16.7214 16.9599 17.0476 17.1716 17.3303 17.4427 17.4693 17.5290 17.6229 17.6950 17.8039 18.0663 18.1369 18.3342 18.4920 18.5371 18.5695 18.9180 18.9830 19.2739 19.4405 19.5119 19.5334 19.7954 20.0003 20.1502 20.3202 20.4511 20.6327 20.8137 21.0047 21.2594 21.4390 21.7268 21.8467 21.8971 22.0514 22.2043 22.2970 22.4554 22.5512 22.7413 22.8608 23.0974 23.2914 23.3563 23.6800 23.8267 23.9026 24.2430 24.3152 24.4933 24.5172 24.6929 24.9340 25.2091 25.2424 25.4241 25.6857 25.8020 25.8997 26.0092 26.0528 26.1636 26.3991 26.5337 26.7106 26.8563 27.0248 27.3446 27.4771 27.6457 27.9146 28.1897 28.2313 28.3433 28.4223 28.5911 28.6559 28.8513 29.1054 29.2041 29.2481 29.3700 29.4451 29.5703 29.6748 29.7243 29.9023 30.0882 30.2634 30.3069 30.4749 30.6764 30.7070 30.9372 31.0101 31.0696 31.1904 31.5496 31.5913 31.7960 31.8673 31.9818 31.9900 32.1272 32.1860 32.3466 32.5138 32.6174 32.9149 33.0586 33.2236 33.2866 33.3826 33.4640 33.6192 33.7365 33.7599 33.8476 33.9241 34.0894 34.2467 34.3869 34.5911 34.8208 34.8572 35.0799 35.1428 35.2463 35.3682 35.6277 35.8576 35.8651 36.0398 36.2033 36.3195 36.4683 36.5826 36.7301 36.9930 37.0486 37.2834 37.4263 37.5912 37.7812 38.0458 38.2245 38.2950 38.3984 38.5473 38.7312 38.8276 38.9205 39.1582 39.3593 39.3945 39.5503 39.8573 39.8861 40.0661 40.2599 40.4416 40.6891 40.7490 40.9623 41.0155 41.0233 41.4454 41.5846 41.6042 41.8960 42.0572 42.1537 42.2665 42.3847 42.4414 42.5596 42.6140 42.7330 42.8197 42.9133 42.9764 43.1470 43.2171 43.3303 43.6228 43.7629 43.9357 43.9741 44.0952 44.1351 44.3560 44.4209 44.6381 44.7105 44.8006 44.9504 45.0688 45.2031 45.3964 45.4942 45.6853 45.8607 46.1680 46.2080 46.3635 46.4991 46.6161 46.8357 46.9168 47.0479 47.0735 47.1527 47.2969 47.5264 47.6657 47.7938 47.9797 48.1201 48.3037 48.4466 48.6116 48.7624 49.1377 49.4545 49.6046 49.6334 49.8895 50.0489 50.2516 50.3811 50.7368 50.8832 51.1799 51.4245 51.6349 51.9108 52.1009 52.4532 52.5874 52.7780 53.3195 53.7316 53.8820 54.0845 54.1666 54.4259 54.8971 55.1152 55.2741 55.7236 56.3003 56.3639 56.6584 56.7551 57.0222 57.3476 57.5594 57.6309 57.9077 58.2467 58.5461 58.6269 59.0639 59.3287 59.5659 59.7499 59.8598 60.3590 60.6479 60.8750 60.9857 61.0469 61.3262 61.7069 61.8787 62.2659 62.3879 62.4910 62.5838 63.0092 63.2214 63.4154 63.7461 63.8120 64.0434 64.7249 64.9900 65.0768 65.5245 65.8425 66.1211 66.2654 66.6202 66.6861 67.4420 67.7783 67.9121 68.1134 68.2738 68.7809 68.8317 68.9933 69.3824 69.5022 69.7585 70.1958 70.5051 70.6521 70.8773 71.0762 71.2122 71.4133 71.5848 71.7293 71.9129 72.0317 72.2969 72.5594 72.7525 73.0310 73.2934 73.4595 73.5497 73.8149 73.8421 74.1415 74.4352 74.7041 74.9374 75.1920 75.2522 75.4549 75.5835 75.6527 75.6865 75.9167 76.1160 76.3090 76.4004 76.8245 77.0146 77.2991 77.5203 77.6786 77.9249 78.1543 78.2245 78.4011 78.5584 78.7886 78.9801 79.2224 79.2659 79.3861 79.4939 79.6972 79.7356 79.9680 80.1729 80.1930 80.3890 80.6063 80.7171 80.8400 80.9677 81.1043 81.1953 81.4130 81.5623 81.6393 81.7286 81.8816 81.9633 82.2135 82.3906 82.5760 82.6862 83.0360 83.1003 83.1387 83.3202 83.4247 83.5355 83.7303 83.8021 83.9521 84.1748 84.3017 84.4428 84.6419 84.7538 85.0384 85.0799 85.0850 85.3127 85.3519 85.4247 85.5910 85.7834 85.8615 86.0218 86.2043 86.3933 86.6043 86.6730 86.8030 86.8518 86.9582 87.0715 87.1652 87.5094 87.5750 87.7907 87.8477 87.8893 88.1015 88.1944 88.3597 88.4933 88.5327 88.7102 88.7840 89.0604 89.1656 89.2370 89.4013 89.5302 89.7319 89.9186 90.0832 90.1620 90.3727 90.5585 90.7476 90.8046 90.8969 91.0674 91.0830 91.2299 91.3586 91.5256 91.7295 91.8634 92.1019 92.3100 92.3975 92.4883 92.6119 92.7162 92.8980 92.9936 93.2078 93.3294 93.3910 93.4443 93.6187 93.7304 94.2074 94.2390 94.4237 94.5179 94.6985 94.8191 94.9477 95.0139 95.1219 95.2621 95.3028 95.4439 95.6073 95.7786 95.8982 96.0462 96.2650 96.3683 96.4751 96.6527 96.6985 96.9281 97.0125 97.1368 97.2146 97.3389 97.4766 97.8376 97.8777 98.0565 98.1978 98.3249 98.4573 98.5842 98.8429 99.0831 99.2757 99.4894 99.5526 99.5777 99.7237 99.8152 99.9925 100.1217 100.2802 100.5977 100.7138 100.7945 100.8796 101.1007 101.2484 101.4896 101.5923 101.7055 101.8663 101.9978 102.1883 102.2811 102.5099 102.6821 102.8741 103.0340 103.1515 103.3309 103.5210 103.7456 103.9788 104.0910 104.3046 104.3542 104.4782 104.5717 104.7607 105.1564 105.3708 105.4142 105.6552 105.9096 106.0320 106.2717 106.3755 106.5974 106.9670 106.9969 107.2331 107.3020 107.6530 107.9134 108.2566 108.4189 108.5139 108.5523 108.6802 108.7281 108.9058 108.9932 109.1588 109.2076 109.6515 109.7602 109.9563 110.0574 110.1481 110.2158 110.3383 110.5108 110.6878 110.7338 111.0882 111.2143 111.3591 111.5429 111.6664 111.9007 111.9774 112.1944 112.2887 112.3465 112.4789 112.6760 112.9235 113.0630 113.2076 113.4547 113.5414 113.7447 113.9595 114.0371 114.1994 114.2960 114.3996 114.6264 114.6595 114.7616 114.8359 115.1838 115.2516 115.4546 115.5144 115.6429 115.6726 115.8488 115.9990 116.0791 116.2960 116.4606 116.6278 116.7474 116.8422 117.0660 117.1921 117.3173 117.3801 117.4797 117.7268 117.9588 118.0165 118.0655 118.1959 118.3656 118.6694 118.8232 119.0250 119.1754 119.2682 119.4728 119.6456 119.8521 120.0610 120.4431 120.5539 120.6432 120.6689 121.0770 121.1652 121.4079 121.6532 121.9348 122.1720 122.2622 122.3149 122.8616 123.0524 123.1474 123.2548 123.4495 124.0446 124.1578 124.3754 124.5442 124.6371 125.0826 125.1929 125.2944 125.4431 125.6997 125.9813 126.2470 126.3557 126.5573 126.7827 126.9846 127.0382 127.7173 127.9963 128.1517 128.4159 128.5893 128.9336 129.0767 129.3439 129.4875 129.6619 129.8823 129.9739 130.1806 130.4059 130.4969 130.5516 130.7699 130.9579 131.1042 131.3908 131.6763 131.7748 132.0961 132.2438 132.6971 132.8486 132.9981 133.7660 133.8471 134.0137 134.2945 134.4716 134.6739 134.7354 135.0087 135.3385 135.4213 135.6782 135.9137 136.1888 136.3518 136.5294 137.1126 137.5454 137.8887 138.1424 138.5233 138.7821 139.0328 139.2752 139.3714 139.7202 139.8108 140.0031 140.1295 140.3766 140.6220 141.2289 141.2888 141.3625 141.6907 141.9088 142.1322 142.2150 142.4310 142.5703 143.1261 143.2541 143.4088 143.6695 143.7392 143.8885 144.2848 144.5242 144.5473 144.7641 144.9972 145.2614 145.3621 145.5551 145.6022 145.8309 145.9885 146.2902 146.4272 146.7817 146.8935 147.0341 147.2885 147.5474 147.8778 148.0309 148.0669 148.4114 148.6308 148.6719 148.9134 149.1754 149.2661 149.4509 149.7221 149.8566 150.1946 150.2733 150.4223 150.5235 150.6473 150.8665 151.0738 151.1808 151.2972 151.4255 151.4574 152.0541 152.3034 152.6011 152.7188 152.8234 153.0611 153.2895 153.8331 154.1521 154.3260 154.7063 154.7758 154.8827 155.0788 155.3264 155.6381 155.9862 156.2729 156.4447 156.4992 156.7738 156.8255 157.4555 157.6183 157.9734 158.0432 158.1008 158.1328 159.1772 159.2191 159.4145 159.6064 159.9837 160.0740 160.1831 160.4301 160.5805 160.7876 161.0971 161.4070 162.0310 163.1363 164.3932 166.0125 166.3860 167.1517 168.8881 169.4569 171.5638 171.7513 172.5684 173.3560 175.4481 175.7567 175.8212 176.5260 178.5303 179.4300 180.2815 181.7765 181.8676 182.2212 185.8530 186.8717 187.4402 187.8518 188.6324 189.3823 191.7464 192.3098 193.1526 195.5237 196.3626 196.4957 196.5586 198.8837 199.2173 204.3235 206.3327 618.8118 621.9182 626.3839 632.0128 636.0311 638.5929 639.8757 640.1473 641.3240 642.5587 642.5732 643.2316 643.6503 644.9523 646.9079 648.7389 650.2224 650.8368 651.5301 902.0142 1199.6658 1200.8326 1202.9397 1210.3125 -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 O O O O 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 H -0.281230 -0.478949 -0.426892 -0.432879 -0.105240 0.173644 -0.042898 -0.106221 -0.277799 -0.298082 -0.284752 0.409072 -0.020073 0.084635 -0.230197 -0.244289 -0.020017 -0.107642 -0.073702 -0.063357 -0.134033 -0.138378 0.310838 0.326938 0.103017 0.100238 0.090746 0.107135 0.092125 0.102172 0.099624 0.092358 0.126723 0.135260 0.145141 0.094806 0.095317 0.090136 0.100109 0.096595 0.076692 0.102077 0.093262 0.102065 0.095447 0.081158 0.078884 0.081630 0.078787 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 O O O O 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 H 8.2812 8.4789 8.4269 8.4329 7.1052 5.8264 6.0429 6.1062 6.2778 6.2981 6.2848 5.5909 6.0201 5.9154 6.2302 6.2443 6.0200 6.1076 6.0737 6.0634 6.1340 6.1384 5.6892 5.6731 0.8970 0.8998 0.9093 0.8929 0.9079 0.8978 0.9004 0.9076 0.8733 0.8647 0.8549 0.9052 0.9047 0.9099 0.8999 0.9034 0.9233 0.8979 0.9067 0.8979 0.9046 0.9188 0.9211 0.9184 0.9212 8.0000 8.0000 8.0000 8.0000 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 1.0000 -0.2812 -0.4789 -0.4269 -0.4329 -0.1052 0.1736 -0.0429 -0.1062 -0.2778 -0.2981 -0.2848 0.4091 -0.0201 0.0846 -0.2302 -0.2443 -0.0200 -0.1076 -0.0737 -0.0634 -0.1340 -0.1384 0.3108 0.3269 0.1030 0.1002 0.0907 0.1071 0.0921 0.1022 0.0996 0.0924 0.1267 0.1353 0.1451 0.0948 0.0953 0.0901 0.1001 0.0966 0.0767 0.1021 0.0933 0.1021 0.0954 0.0812 0.0789 0.0816 0.0788 2.1148 2.0136 2.0810 2.0676 3.0795 3.7185 3.8521 3.8122 3.8801 3.9060 3.8811 4.1535 3.7115 3.8949 3.9282 3.9373 3.6110 3.7179 3.9111 3.9121 3.9141 3.9213 4.1930 4.1564 1.0221 1.0297 1.0088 1.0019 1.0121 0.9982 1.0027 1.0008 1.0019 1.0138 0.9927 0.9963 0.9956 1.0064 0.9988 0.9985 1.0216 1.0038 1.0157 1.0064 1.0158 1.0094 1.0076 1.0093 1.0061 2.1148 2.0136 2.0810 2.0676 3.0795 3.7185 3.8521 3.8122 3.8801 3.9060 3.8811 4.1535 3.7115 3.8949 3.9282 3.9373 3.6110 3.7179 3.9111 3.9121 3.9141 3.9213 4.1930 4.1564 1.0221 1.0297 1.0088 1.0019 1.0121 0.9982 1.0027 1.0008 1.0019 1.0138 0.9927 0.9963 0.9956 1.0064 0.9988 0.9985 1.0216 1.0038 1.0157 1.0064 1.0158 1.0094 1.0076 1.0093 1.0061 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 1.1590 0.8935 1.8545 2.0170 1.9884 0.9213 1.1263 1.0963 0.9493 0.8642 0.9353 0.9209 0.9377 0.9603 0.9959 1.0048 1.0036 0.9942 0.9882 0.9845 0.9957 0.9893 0.9960 1.8593 0.9915 0.9632 0.9643 0.9852 0.9724 0.9822 0.9799 1.0000 0.9841 0.9833 0.9999 1.7245 0.9793 0.9333 0.9791 0.9632 0.9296 0.9804 1.0012 0.9284 0.9802 1.0004 0.9257 1.0070 1.0073 1.0068 1.0067 0 11 0 13 1 11 2 22 3 23 4 13 4 22 4 23 5 6 5 7 5 8 5 9 6 7 6 10 6 24 7 11 7 25 8 26 8 27 8 28 9 29 9 30 9 31 10 12 10 32 12 14 12 15 13 33 13 34 14 35 14 36 14 37 15 38 15 39 15 40 16 17 16 18 16 22 17 19 17 23 18 20 18 41 18 42 19 21 19 43 19 44 20 21 20 45 20 46 21 47 21 48 -0.025790255 -1094.893128630975 17.37611 -17.60040 -0.22429 -12.20131 12.36207 0.16076 13.32031 -11.89543 1.42488 1.45136 3.68906