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:-.2494,1.496,-.0255;-1.5242,1.2255,-1.852;3.0677,2.6085,1.0201;1.4738,-.7497,-1.589;2.0094,1.176,-.4469;-3.7954,1.0753,.3249;-3.4842,-.2933,-.1976;-2.3543,.587,.299;-4.2731,2.1239,-.6485;-4.4096,1.2235,1.6955;-3.8187,-1.5232,.55;-1.3722,1.1193,-.6579;-4.5385,-2.5528,.0913;.8629,1.949,-.7883;-4.8182,-3.7421,.9605;-5.1411,-2.6297,-1.2783;3.9283,.3924,.5555;3.4577,-.5982,-.2038;5.1768,.3355,1.3537;4.087,-1.932,-.3546;6.0077,-.8697,.9103;5.1478,-2.1198,.7315;3.0008,1.5461,.4544;2.2074,-.1374,-.8529;-3.541,-.3698,-1.2782;-1.9445,.3393,1.2719;-3.9194,1.9635,-1.6641;-5.3639,2.1158,-.6808;-3.9637,3.1224,-.3352;-4.2414,2.2306,2.0808;-5.4886,1.0652,1.6467;-4.0036,.5215,2.4222;-3.4468,-1.5797,1.569;1.0515,2.9906,-.5385;.6722,1.8745,-1.856;-5.8942,-3.8968,1.0762;-4.4228,-4.6571,.5121;-4.3843,-3.6381,1.9548;-6.232,-2.633,-1.2128;-4.8564,-1.81,-1.9344;-4.8621,-3.564,-1.7704;5.7417,1.2633,1.2407;4.9237,.263,2.4158;3.3297,-2.7174,-.3025;4.5333,-2.009,-1.3508;6.5041,-.635,-.0353;6.7961,-1.0572,1.6396;4.6554,-2.3579,1.6781;5.7766,-2.9748,.4823; 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 2050.6318714685 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 1.464e-05 Time for diagonalization 0.237 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.219 sec Total time needed 0.462 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:-.2494,1.496,-.0255;-1.5242,1.2255,-1.852;3.0677,2.6085,1.0201;1.4738,-.7497,-1.589;2.0094,1.176,-.4469;-3.7954,1.0753,.3249;-3.4842,-.2933,-.1976;-2.3543,.587,.299;-4.2731,2.1239,-.6485;-4.4096,1.2235,1.6955;-3.8187,-1.5232,.55;-1.3722,1.1193,-.6579;-4.5385,-2.5528,.0913;.8629,1.949,-.7883;-4.8182,-3.7421,.9605;-5.1411,-2.6297,-1.2783;3.9283,.3924,.5555;3.4577,-.5982,-.2038;5.1768,.3355,1.3537;4.087,-1.932,-.3546;6.0077,-.8697,.9103;5.1478,-2.1198,.7315;3.0008,1.5461,.4544;2.2074,-.1374,-.8529;-3.541,-.3698,-1.2782;-1.9445,.3393,1.2719;-3.9194,1.9635,-1.6641;-5.3639,2.1158,-.6808;-3.9637,3.1224,-.3352;-4.2414,2.2306,2.0808;-5.4886,1.0652,1.6467;-4.0036,.5215,2.4222;-3.4468,-1.5797,1.569;1.0515,2.9906,-.5385;.6722,1.8745,-1.856;-5.8942,-3.8968,1.0762;-4.4228,-4.6571,.5121;-4.3843,-3.6381,1.9548;-6.232,-2.633,-1.2128;-4.8564,-1.81,-1.9344;-4.8621,-3.564,-1.7704;5.7417,1.2633,1.2407;4.9237,.263,2.4158;3.3297,-2.7174,-.3025;4.5333,-2.009,-1.3508;6.5041,-.635,-.0353;6.7961,-1.0572,1.6396;4.6554,-2.3579,1.6781;5.7766,-2.9748,.4823; 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:-.2494,1.496,-.0255;-1.5242,1.2255,-1.852;3.0677,2.6085,1.0201;1.4738,-.7497,-1.589;2.0094,1.176,-.4469;-3.7954,1.0753,.3249;-3.4842,-.2933,-.1976;-2.3543,.587,.299;-4.2731,2.1239,-.6485;-4.4096,1.2235,1.6955;-3.8187,-1.5232,.55;-1.3722,1.1193,-.6579;-4.5385,-2.5528,.0913;.8629,1.949,-.7883;-4.8182,-3.7421,.9605;-5.1411,-2.6297,-1.2783;3.9283,.3924,.5555;3.4577,-.5982,-.2038;5.1768,.3355,1.3537;4.087,-1.932,-.3546;6.0077,-.8697,.9103;5.1478,-2.1198,.7315;3.0008,1.5461,.4544;2.2074,-.1374,-.8529;-3.541,-.3698,-1.2782;-1.9445,.3393,1.2719;-3.9194,1.9635,-1.6641;-5.3639,2.1158,-.6808;-3.9637,3.1224,-.3352;-4.2414,2.2306,2.0808;-5.4886,1.0652,1.6467;-4.0036,.5215,2.4222;-3.4468,-1.5797,1.569;1.0515,2.9906,-.5385;.6722,1.8745,-1.856;-5.8942,-3.8968,1.0762;-4.4228,-4.6571,.5121;-4.3843,-3.6381,1.9548;-6.232,-2.633,-1.2128;-4.8564,-1.81,-1.9344;-4.8621,-3.564,-1.7704;5.7417,1.2633,1.2407;4.9237,.263,2.4158;3.3297,-2.7174,-.3025;4.5333,-2.009,-1.3508;6.5041,-.635,-.0353;6.7961,-1.0572,1.6396;4.6554,-2.3579,1.6781;5.7766,-2.9748,.4823; 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 2904 GEPOL Volume 2277.8656 GEPOL Surface-area 1348.1917 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 0.5s) Overall time for CPCM initialization 0.5s -1094.87004970 2050.63187147 -3145.50192117 -5563.68657306 2418.18465189 -0.03885257 -2184.91317966 1090.04312996 2.00442819 89.000016994751 89.000016994751 178.000033989501 -105.975151413390 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 -524.8809 -523.6694 -523.6626 -523.1965 -393.9633 -283.5442 -283.4001 -283.3746 -282.3374 -280.4680 -280.4437 -280.3258 -280.0040 -279.9160 -279.7425 -279.7336 -279.7332 -279.4141 -279.4084 -279.2988 -279.1606 -279.1437 -279.1355 -279.1259 -33.8491 -32.9412 -32.4314 -31.3318 -29.7799 -27.3880 -26.8184 -25.1571 -24.9078 -23.8562 -23.4694 -22.9969 -22.0589 -21.7984 -21.7216 -21.3395 -20.9455 -20.0682 -19.7451 -18.7627 -18.3455 -18.0464 -17.8921 -17.4755 -16.8464 -16.5525 -16.3708 -16.1284 -15.9370 -15.6821 -15.4717 -15.2825 -15.1131 -14.9968 -14.6107 -14.4917 -14.4665 -14.3290 -14.0878 -13.9789 -13.9361 -13.8756 -13.5294 -13.3891 -13.1302 -13.0778 -12.8563 -12.8407 -12.7732 -12.5286 -12.3506 -12.0492 -11.7800 -11.6177 -11.4929 -11.4002 -11.3552 -11.0273 -10.9188 -10.8642 -10.5430 -10.2884 -10.0645 -9.6297 -8.4560 -0.4492 1.9806 2.7647 3.1530 3.1892 3.3720 3.7957 3.9824 4.0494 4.1957 4.2924 4.4724 4.5779 4.7839 4.8291 4.8953 4.9495 5.0236 5.2829 5.3037 5.3703 5.5584 5.6362 5.7021 5.7653 5.8652 5.9884 6.0834 6.2825 6.3324 6.4172 6.5043 6.5902 6.6431 6.7019 6.7953 6.9886 6.9980 7.0776 7.1941 7.2915 7.4061 7.5215 7.6291 7.7843 7.8899 7.8978 8.0615 8.1411 8.3481 8.3929 8.5390 8.6790 8.8245 8.8786 8.9915 9.2377 9.2891 9.4485 9.5267 9.7504 9.8014 10.0150 10.0915 10.1978 10.3384 10.5156 10.6500 10.6990 10.9033 10.9720 11.0568 11.1452 11.2642 11.4023 11.4266 11.5442 11.8728 12.0946 12.1603 12.2903 12.3353 12.4374 12.6460 12.7242 12.7897 12.8756 13.0398 13.1966 13.3435 13.4034 13.4728 13.5266 13.5944 13.6545 13.6813 13.8361 13.9286 14.0089 14.0785 14.1454 14.2577 14.4200 14.4331 14.4874 14.5368 14.6258 14.8014 14.8907 15.0043 15.0300 15.0889 15.1419 15.1836 15.3026 15.4146 15.4284 15.4793 15.5214 15.6099 15.7009 15.7262 15.8543 15.9215 16.1106 16.2031 16.3327 16.4503 16.4875 16.7106 16.7439 17.0232 17.1013 17.1822 17.2639 17.4356 17.5417 17.5496 17.7842 17.8365 18.0850 18.1974 18.3660 18.4895 18.6023 18.8446 18.9814 19.1301 19.3627 19.4136 19.4410 19.8288 19.8787 20.1012 20.2498 20.4153 20.6442 20.7292 20.8508 20.9037 21.0399 21.1641 21.5001 21.7322 21.9225 22.0491 22.1696 22.2853 22.4798 22.6202 22.8845 23.0321 23.1723 23.2968 23.5460 23.6698 23.7656 23.8814 23.8933 24.0874 24.2279 24.4032 24.6803 24.7792 24.9663 25.1134 25.2131 25.3093 25.4209 25.5707 25.9441 26.1505 26.3581 26.4674 26.6178 26.7325 26.9332 27.0381 27.1110 27.3331 27.3805 27.6467 27.7992 28.1120 28.3291 28.4489 28.6256 28.8026 28.8617 29.0106 29.1237 29.1403 29.2986 29.3277 29.6783 29.6985 29.7653 29.9974 30.0955 30.2009 30.2617 30.3231 30.4572 30.5182 30.7141 30.9423 31.0680 31.1483 31.3201 31.4760 31.5109 31.5813 31.7294 32.0111 32.1202 32.4318 32.5092 32.6562 32.7536 32.8650 33.1283 33.1798 33.3329 33.4093 33.5579 33.6509 33.6958 33.7502 33.8055 33.9428 33.9898 34.2246 34.4355 34.5128 34.7421 34.9623 35.0464 35.2905 35.4352 35.6822 35.7571 35.9959 36.1756 36.2285 36.3873 36.5411 36.6404 36.8262 36.8748 36.9926 37.1494 37.2826 37.3305 37.3974 37.5265 37.7466 37.8718 38.0473 38.3775 38.5744 38.7294 38.8759 39.1812 39.2895 39.3252 39.4433 39.6189 39.6928 40.1653 40.1881 40.3134 40.4612 40.5476 40.7388 41.0343 41.0552 41.2457 41.3761 41.4678 41.6416 41.7436 41.8665 42.0992 42.1956 42.3005 42.3613 42.4267 42.6767 42.7050 42.8365 43.0378 43.0673 43.2267 43.3073 43.3990 43.6351 43.6883 43.7389 43.8729 43.9658 44.0626 44.2586 44.3931 44.4554 44.6364 44.6935 44.8231 44.9046 45.2347 45.4892 45.5445 45.7643 46.0818 46.1853 46.3707 46.4274 46.6211 46.6749 46.8037 46.9209 47.0743 47.1248 47.2733 47.3935 47.5233 47.6555 47.7889 47.8650 48.0134 48.2288 48.2934 48.5174 48.7705 48.8644 49.0041 49.3164 49.7543 49.9405 50.0086 50.3751 50.4622 50.6399 51.0883 51.3427 51.6029 51.9461 52.0358 52.2816 52.3932 52.7545 52.9029 53.0298 53.5270 53.7249 53.9427 54.2585 54.7170 54.8630 55.2961 55.9243 56.1755 56.2033 56.6037 56.8469 56.9277 57.2060 57.4506 57.6435 57.9171 58.1859 58.6618 58.8323 59.0634 59.2466 59.7238 59.9635 60.1693 60.3152 60.6009 60.6198 61.0764 61.5780 61.7298 61.8265 62.1426 62.3714 62.4955 62.7085 62.7975 63.0552 63.1686 63.2923 63.4618 64.0415 64.3880 64.5207 64.9012 65.2095 65.4957 65.8584 65.9763 66.1730 67.0711 67.1493 67.4389 67.7221 67.8492 68.0483 68.2158 68.7701 69.0248 69.3620 69.5659 69.7317 70.2337 70.4541 70.6778 70.7532 70.8448 71.0098 71.2451 71.5877 71.7014 71.8559 72.0802 72.1503 72.5405 72.6767 72.7734 72.8149 73.0416 73.2021 73.4403 73.6937 73.9547 74.3703 74.5990 74.8168 74.9582 75.0971 75.3261 75.4211 75.5239 75.5769 75.7350 75.8027 76.3605 76.5829 76.7233 76.9008 77.2096 77.3239 77.5748 77.6979 77.8875 78.0726 78.2173 78.4924 78.5531 78.6940 78.8402 78.9964 79.1915 79.3437 79.4315 79.5670 79.6268 79.7312 79.7895 79.9539 80.1584 80.3359 80.4987 80.6249 80.7781 80.9706 81.0424 81.1712 81.3425 81.5115 81.5840 81.7655 81.9067 82.0053 82.1446 82.4432 82.5171 82.8155 82.9355 83.0685 83.1911 83.2344 83.6925 83.7453 83.8223 83.8854 84.0952 84.1951 84.3393 84.5660 84.7964 84.8184 85.0131 85.0658 85.1750 85.3078 85.3887 85.4212 85.5446 85.6819 85.8111 85.9655 85.9921 86.2214 86.4252 86.4561 86.5348 86.6417 86.9304 87.0667 87.1812 87.3530 87.5000 87.6149 87.8595 87.9167 88.1107 88.2013 88.4649 88.5605 88.7800 88.8800 89.0207 89.1075 89.1880 89.3120 89.4045 89.5238 89.6950 89.8515 90.0183 90.1696 90.3163 90.5259 90.5931 90.6648 90.8648 90.9928 91.1339 91.2987 91.3887 91.5995 91.8193 91.9955 92.1260 92.1851 92.3354 92.4810 92.6315 92.8033 92.9239 93.1217 93.3709 93.4771 93.5674 93.6926 93.7395 93.8460 93.8859 94.1922 94.2593 94.3974 94.6529 94.6979 94.7849 94.9280 95.0750 95.2563 95.3052 95.4338 95.5789 95.6661 96.0265 96.1726 96.1917 96.4199 96.7096 96.7791 96.8249 97.0726 97.1300 97.3446 97.4566 97.6604 97.9517 97.9695 98.0436 98.1258 98.3454 98.3898 98.6669 98.7500 99.0641 99.3734 99.3959 99.5803 99.6738 99.7674 99.8904 99.9254 100.1719 100.3759 100.4721 100.8311 100.9068 100.9442 101.3360 101.4041 101.5590 101.7419 101.8695 102.0689 102.2579 102.3078 102.6667 102.6950 102.8529 103.0304 103.2720 103.3881 103.5079 103.6491 103.7054 103.9106 103.9268 104.4278 104.5777 104.6948 104.7426 104.8306 104.8851 105.3012 105.4626 105.8447 105.8653 106.0055 106.0452 106.3827 106.6861 106.8680 107.0122 107.2911 107.4207 107.4846 107.5548 107.7793 107.9675 108.3972 108.5190 108.6858 108.8299 109.0578 109.1593 109.2025 109.4300 109.5848 109.6393 109.7515 109.9396 110.1050 110.2836 110.4556 110.5126 110.7402 110.9250 110.9658 111.0294 111.2383 111.4436 111.6885 111.7667 111.8611 111.8755 112.0222 112.3269 112.5373 112.6068 112.7641 113.0967 113.1772 113.3904 113.4808 113.6904 113.8646 113.9196 114.1284 114.3191 114.5081 114.6260 114.7682 114.8731 114.9711 115.1835 115.2455 115.2655 115.3167 115.4239 115.6733 115.7377 115.9408 115.9596 116.2903 116.4047 116.5600 116.6416 117.0645 117.1662 117.2484 117.3791 117.4506 117.5358 117.6967 117.7906 117.8681 117.9866 118.2673 118.3718 118.6206 118.8273 119.0307 119.0982 119.3682 119.4806 119.5326 120.0914 120.2239 120.2858 120.3279 120.5984 120.7869 121.2536 121.2834 121.3987 121.6665 122.3080 122.3787 122.4519 122.6663 122.8795 122.9615 123.3677 123.5745 123.7702 123.9436 124.0225 124.3593 124.5031 124.9405 125.2638 125.4923 125.8161 125.9162 126.1806 126.2703 126.3599 126.7774 126.8621 127.0115 127.4445 127.6605 127.6888 128.0696 128.2270 128.4949 128.7795 128.9537 129.1374 129.2520 129.4334 129.6787 129.8681 130.0162 130.2622 130.3215 130.4030 130.5544 130.9222 131.1017 131.2901 131.4966 131.6819 131.9485 132.0977 132.4736 132.6808 133.2982 133.3830 133.4971 133.8459 134.0937 134.2245 134.3496 134.4309 134.6343 134.8542 135.0389 135.3267 135.7078 135.8007 136.2889 136.9697 137.3848 137.6412 137.7720 137.9040 138.5633 138.7862 139.1689 139.2211 139.4030 139.6672 139.7887 139.9625 140.1510 140.2491 140.4734 140.8838 141.0171 141.3479 141.4035 141.8021 141.9182 142.2850 142.5479 142.8454 143.0070 143.1108 143.3788 143.4518 143.6255 143.8973 144.0221 144.2004 144.5526 144.8048 144.9534 145.3174 145.4716 145.5215 145.6264 145.7141 146.1241 146.2163 146.2992 146.5817 146.7291 146.8232 147.0015 147.3764 147.5333 147.8014 148.2124 148.3596 148.5251 148.7798 148.9806 149.1271 149.3462 149.6548 149.7484 149.9102 150.0437 150.1762 150.3125 150.6539 150.8103 150.9769 151.0499 151.2565 151.3825 151.4989 151.7238 151.9048 152.0488 152.2648 152.6638 152.8837 152.9615 153.1301 153.5214 153.7350 153.9247 154.2700 154.6050 154.8060 154.9073 155.4781 155.8180 155.9327 156.2908 156.3443 156.5011 156.7599 157.3238 157.4559 157.8219 157.9273 157.9976 158.0221 158.0429 159.0121 159.3506 159.5395 159.6535 159.8291 159.9160 160.0511 160.4278 160.5245 161.3255 161.6629 161.9862 163.0653 163.9443 163.9754 166.1070 166.6116 167.6008 168.5421 170.4968 170.9079 171.2932 172.9829 173.1890 175.6722 175.8216 176.1830 176.6691 177.8951 179.0237 180.1443 181.6158 182.1994 182.9203 184.1760 186.5008 187.3925 187.8410 188.1762 188.6391 192.3594 192.6409 194.8781 195.6170 195.9316 196.4100 196.6822 198.0015 199.1987 204.0877 206.8630 618.0892 621.2083 627.4546 630.5156 635.6442 638.2555 640.0040 640.6721 641.1707 642.4419 642.6813 643.2613 643.7476 645.0057 646.9577 647.5387 649.9705 650.3555 651.6403 902.9975 1198.8650 1199.2749 1200.2748 1209.8615 -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 -0.285622 -0.486580 -0.434803 -0.437676 -0.098677 0.113924 0.040285 -0.136150 -0.279834 -0.265507 -0.282906 0.439315 -0.048208 0.080025 -0.218967 -0.252527 -0.081349 -0.056627 -0.073817 -0.071985 -0.135121 -0.136244 0.345201 0.335855 0.093881 0.093963 0.092125 0.097024 0.099884 0.099019 0.097724 0.089730 0.123207 0.127275 0.140218 0.093193 0.094720 0.089106 0.098985 0.089973 0.094989 0.093916 0.102699 0.094242 0.102033 0.078530 0.081234 0.078698 0.081627 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 8.2856 8.4866 8.4348 8.4377 7.0987 5.8861 5.9597 6.1361 6.2798 6.2655 6.2829 5.5607 6.0482 5.9200 6.2190 6.2525 6.0813 6.0566 6.0738 6.0720 6.1351 6.1362 5.6548 5.6641 0.9061 0.9060 0.9079 0.9030 0.9001 0.9010 0.9023 0.9103 0.8768 0.8727 0.8598 0.9068 0.9053 0.9109 0.9010 0.9100 0.9050 0.9061 0.8973 0.9058 0.8980 0.9215 0.9188 0.9213 0.9184 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 -0.2856 -0.4866 -0.4348 -0.4377 -0.0987 0.1139 0.0403 -0.1361 -0.2798 -0.2655 -0.2829 0.4393 -0.0482 0.0800 -0.2190 -0.2525 -0.0813 -0.0566 -0.0738 -0.0720 -0.1351 -0.1362 0.3452 0.3359 0.0939 0.0940 0.0921 0.0970 0.0999 0.0990 0.0977 0.0897 0.1232 0.1273 0.1402 0.0932 0.0947 0.0891 0.0990 0.0900 0.0950 0.0939 0.1027 0.0942 0.1020 0.0785 0.0812 0.0787 0.0816 2.1079 2.0208 2.0771 2.0736 3.1087 3.6861 3.7583 3.8608 3.9057 3.9079 3.8630 4.1366 3.7570 3.8546 3.9200 3.9424 3.7106 3.6764 3.9196 3.9185 3.9148 3.9160 4.1974 4.1959 1.0320 1.0370 1.0179 1.0000 0.9994 1.0022 1.0020 1.0051 1.0089 1.0128 1.0182 0.9960 0.9962 1.0085 0.9966 1.0097 0.9973 1.0154 1.0047 1.0153 1.0046 1.0068 1.0094 1.0067 1.0092 2.1079 2.0208 2.0771 2.0736 3.1087 3.6861 3.7583 3.8608 3.9057 3.9079 3.8630 4.1366 3.7570 3.8546 3.9200 3.9424 3.7106 3.6764 3.9196 3.9185 3.9148 3.9160 4.1974 4.1959 1.0320 1.0370 1.0179 1.0000 0.9994 1.0022 1.0020 1.0051 1.0089 1.0128 1.0182 0.9960 0.9962 1.0085 0.9966 1.0097 0.9973 1.0154 1.0047 1.0153 1.0046 1.0068 1.0094 1.0067 1.0092 -0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 1.1595 0.8729 1.8745 1.9992 1.9964 0.9508 1.1089 1.1209 0.8724 0.8703 0.9484 0.9509 0.9266 0.9852 1.0062 1.0386 1.0128 0.9858 0.9885 0.9944 0.9900 0.9943 0.9874 1.8474 0.9782 0.9646 0.9726 0.9741 0.9813 0.9801 0.9815 0.9999 0.9819 1.0018 0.9841 1.7379 0.9756 0.9764 0.9763 0.9619 0.9297 0.9997 0.9831 0.9297 1.0001 0.9824 0.9252 1.0067 1.0072 1.0067 1.0070 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 -0.021867483 -1094.891917187266 -21.13787 22.16348 1.02562 -15.13819 14.08848 -1.04971 6.76652 -5.46613 1.30039 1.96081 4.98399