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:-.6813,.8474,.9398;-.3483,1.6701,-1.1082;2.3635,2.8031,-.4108;1.6494,-1.0255,1.9398;1.6809,1.0495,.9353;-2.3323,-1.3236,-.469;-3.2562,-.2929,.108;-2.1204,.1448,-.8012;-1.3998,-2.0621,.46;-2.8065,-2.1833,-1.6173;-4.643,-.1281,-.376;-.9755,.9562,-.3587;-5.7546,-.1364,.3668;.4458,1.5541,1.4457;-7.1014,.025,-.272;-5.7893,-.3118,1.854;3.5099,.6759,-.4182;3.3079,-.4457,.2742;4.5965,.8866,-1.4051;4.1209,-1.6802,.1541;5.6365,-.2259,-1.263;4.983,-1.5982,-1.107;2.4816,1.6688,-.0228;2.1373,-.2449,1.16;-3.0966,-.0972,1.1625;-2.4142,.4139,-1.81;-.4412,-2.2665,-.021;-1.2122,-1.537,1.3928;-1.8457,-3.0244,.7185;-3.4185,-1.6384,-2.334;-1.954,-2.5967,-2.1592;-3.3972,-3.0216,-1.2433;-4.7567,-.0006,-1.4488;.3982,1.4136,2.522;.3813,2.6194,1.2289;-7.7364,-.8403,-.0654;-7.6267,.8949,.1302;-7.033,.1423,-1.3531;-4.8068,-.4239,2.3083;-6.2836,.5388,2.3297;-6.3775,-1.1942,2.1187;4.1691,.8916,-2.4127;5.0522,1.8696,-1.2665;4.7461,-1.7906,1.0455;3.4731,-2.5593,.1286;6.2961,-.2213,-2.1313;6.2632,-.0226,-.3904;5.7467,-2.3761,-1.078;4.3593,-1.8023,-1.9816; 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 2115.3073214082 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 1.299e-05 Time for diagonalization 0.273 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.259 sec Total time needed 0.539 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:-.6813,.8474,.9398;-.3483,1.6701,-1.1082;2.3635,2.8031,-.4108;1.6494,-1.0255,1.9398;1.6809,1.0495,.9353;-2.3323,-1.3236,-.469;-3.2562,-.2929,.108;-2.1204,.1448,-.8012;-1.3998,-2.0621,.46;-2.8065,-2.1833,-1.6173;-4.643,-.1281,-.376;-.9755,.9562,-.3587;-5.7546,-.1364,.3668;.4458,1.5541,1.4457;-7.1014,.025,-.272;-5.7893,-.3118,1.854;3.5099,.6759,-.4182;3.3079,-.4457,.2742;4.5965,.8866,-1.4051;4.1209,-1.6802,.1541;5.6365,-.2259,-1.263;4.983,-1.5982,-1.107;2.4816,1.6688,-.0228;2.1373,-.2449,1.16;-3.0966,-.0972,1.1625;-2.4142,.4139,-1.81;-.4412,-2.2665,-.021;-1.2122,-1.537,1.3928;-1.8457,-3.0244,.7185;-3.4185,-1.6384,-2.334;-1.954,-2.5967,-2.1592;-3.3972,-3.0216,-1.2433;-4.7567,-.0006,-1.4488;.3982,1.4136,2.522;.3813,2.6194,1.2289;-7.7364,-.8403,-.0654;-7.6267,.8949,.1302;-7.033,.1423,-1.3531;-4.8068,-.4239,2.3083;-6.2836,.5388,2.3297;-6.3775,-1.1942,2.1187;4.1691,.8916,-2.4127;5.0522,1.8696,-1.2665;4.7461,-1.7906,1.0455;3.4731,-2.5593,.1286;6.2961,-.2213,-2.1313;6.2632,-.0226,-.3904;5.7467,-2.3761,-1.078;4.3593,-1.8023,-1.9816; 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:-.6813,.8474,.9398;-.3483,1.6701,-1.1082;2.3635,2.8031,-.4108;1.6494,-1.0255,1.9398;1.6809,1.0495,.9353;-2.3323,-1.3236,-.469;-3.2562,-.2929,.108;-2.1204,.1448,-.8012;-1.3998,-2.0621,.46;-2.8065,-2.1833,-1.6173;-4.643,-.1281,-.376;-.9755,.9562,-.3587;-5.7546,-.1364,.3668;.4458,1.5541,1.4457;-7.1014,.025,-.272;-5.7893,-.3118,1.854;3.5099,.6759,-.4182;3.3079,-.4457,.2742;4.5965,.8866,-1.4051;4.1209,-1.6802,.1541;5.6365,-.2259,-1.263;4.983,-1.5982,-1.107;2.4816,1.6688,-.0228;2.1373,-.2449,1.16;-3.0966,-.0972,1.1625;-2.4142,.4139,-1.81;-.4412,-2.2665,-.021;-1.2122,-1.537,1.3928;-1.8457,-3.0244,.7185;-3.4185,-1.6384,-2.334;-1.954,-2.5967,-2.1592;-3.3972,-3.0216,-1.2433;-4.7567,-.0006,-1.4488;.3982,1.4136,2.522;.3813,2.6194,1.2289;-7.7364,-.8403,-.0654;-7.6267,.8949,.1302;-7.033,.1423,-1.3531;-4.8068,-.4239,2.3083;-6.2836,.5388,2.3297;-6.3775,-1.1942,2.1187;4.1691,.8916,-2.4127;5.0522,1.8696,-1.2665;4.7461,-1.7906,1.0455;3.4731,-2.5593,.1286;6.2961,-.2213,-2.1313;6.2632,-.0226,-.3904;5.7467,-2.3761,-1.078;4.3593,-1.8023,-1.9816; 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 2908 GEPOL Volume 2257.3689 GEPOL Surface-area 1338.6384 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 0.5s) Overall time for CPCM initialization 0.6s -1094.86778300 2115.30732141 -3210.17510441 -5693.08677581 2482.91167140 -0.04157460 -2184.90238477 1090.03460177 2.00443397 89.000095952898 89.000095952898 178.000191905797 -105.974363826589 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 -524.9035 -523.6572 -523.6274 -523.1726 -393.9617 -283.5328 -283.3728 -283.3697 -282.4247 -280.4543 -280.4300 -280.3244 -280.0183 -279.9548 -279.7410 -279.7313 -279.7276 -279.4124 -279.4066 -279.2984 -279.1579 -279.1490 -279.1339 -279.1237 -33.9427 -32.8940 -32.4143 -31.2839 -29.7544 -27.4038 -26.7866 -25.1584 -24.8532 -23.8479 -23.4420 -22.9903 -22.0425 -21.8035 -21.7239 -21.3155 -20.9222 -20.2015 -19.7737 -19.1299 -18.1955 -18.0497 -17.7381 -17.3500 -17.0118 -16.5173 -16.2635 -16.1959 -15.8763 -15.7372 -15.3729 -15.1436 -15.0494 -14.9851 -14.6151 -14.4787 -14.4668 -14.3845 -14.2288 -13.9900 -13.9564 -13.7725 -13.5262 -13.4467 -13.1073 -13.0564 -12.8501 -12.8052 -12.7835 -12.5204 -12.3329 -11.9919 -11.8006 -11.6090 -11.4854 -11.4493 -11.3970 -11.1176 -10.8765 -10.7853 -10.5939 -10.2766 -10.0483 -9.6113 -8.4271 -0.4387 1.9325 2.7778 3.0059 3.0965 3.4250 3.7589 3.8972 4.0711 4.2238 4.3124 4.4583 4.5048 4.7007 4.7767 4.9398 4.9934 5.0893 5.2590 5.3780 5.4110 5.5308 5.6007 5.7609 5.8273 5.9830 6.0200 6.0815 6.2058 6.3142 6.4164 6.4480 6.5872 6.6860 6.7584 6.8971 6.9574 7.0765 7.2450 7.3344 7.4368 7.5386 7.6283 7.7006 7.8066 7.9677 8.0112 8.0935 8.2097 8.3138 8.3412 8.6744 8.8152 8.8668 9.0392 9.0903 9.2050 9.3367 9.4980 9.6503 9.8129 9.9414 10.0191 10.2756 10.3755 10.4643 10.5683 10.6548 10.8178 10.8829 10.9920 11.0431 11.2392 11.3593 11.3636 11.6543 11.8618 11.9663 12.0250 12.1721 12.3431 12.4174 12.5561 12.6234 12.8076 12.9014 13.0553 13.1522 13.3019 13.3728 13.4152 13.4616 13.5555 13.5814 13.6659 13.7421 13.9189 14.0366 14.0420 14.1657 14.1942 14.2853 14.3422 14.3935 14.5543 14.6403 14.7485 14.8074 14.8641 14.9882 15.0877 15.1267 15.2366 15.2807 15.3688 15.4373 15.4910 15.5594 15.5950 15.6351 15.8036 15.9092 15.9806 16.2587 16.3646 16.3967 16.4517 16.5782 16.7793 16.8515 17.0775 17.1196 17.3108 17.3930 17.4236 17.5877 17.7101 17.7215 17.9092 17.9577 18.1421 18.2864 18.5711 18.6981 18.8936 19.0648 19.1151 19.4575 19.4888 19.7092 19.7390 19.9845 20.1044 20.2583 20.4449 20.5463 20.6459 20.8711 21.0699 21.3259 21.4136 21.7347 21.8381 21.9413 22.0557 22.1766 22.2951 22.5908 22.8564 22.8790 22.9205 23.1824 23.4364 23.5005 23.5731 23.7885 23.9160 24.1126 24.3421 24.4105 24.5543 24.8821 24.9953 25.2230 25.3065 25.5214 25.5590 25.7470 25.8220 26.0104 26.2821 26.3667 26.4388 26.5457 26.8330 26.8721 27.0633 27.2506 27.2899 27.4522 27.7122 27.8289 28.0631 28.3360 28.4907 28.5942 28.8135 28.8989 29.0916 29.1314 29.2407 29.2950 29.3598 29.6333 29.7060 29.8686 30.0768 30.1578 30.2306 30.3411 30.3971 30.5055 30.6923 30.8418 30.9499 31.0451 31.2208 31.4506 31.5223 31.6301 31.6788 31.9649 32.0978 32.1968 32.2864 32.4784 32.5296 32.6327 32.8789 33.0666 33.2083 33.3142 33.3790 33.4721 33.6064 33.6606 33.7258 33.9052 33.9200 33.9466 34.2042 34.4033 34.4394 34.6919 34.7908 34.9060 35.1347 35.1781 35.4445 35.6526 35.8450 36.0069 36.1057 36.3553 36.4777 36.7560 36.7912 36.9229 37.0581 37.1832 37.3177 37.5418 37.6128 37.6607 37.7841 37.9924 38.1710 38.4703 38.7185 38.8211 38.8565 38.9223 39.1924 39.3441 39.4465 39.5733 39.8724 40.0952 40.1664 40.4199 40.4438 40.6329 40.6818 40.9276 41.0297 41.1135 41.2102 41.5649 41.6911 41.8175 42.0611 42.1023 42.2673 42.2993 42.3976 42.5762 42.6676 42.7934 42.8404 43.0048 43.1019 43.2266 43.2732 43.3496 43.5862 43.7339 43.7591 43.8294 43.9628 44.1048 44.3326 44.4205 44.5526 44.6493 44.7351 44.8449 45.0111 45.1376 45.3466 45.5370 45.8047 46.0259 46.0895 46.3047 46.5577 46.5863 46.7103 46.8216 46.8691 47.0691 47.2310 47.3461 47.4611 47.7265 47.7958 47.8521 47.9067 48.1207 48.1432 48.3007 48.6162 48.9898 49.0404 49.3705 49.4490 49.4789 49.9130 50.2051 50.2573 50.5171 51.0241 51.1644 51.3464 51.5510 51.6385 51.9410 52.0519 52.2186 52.7353 53.1293 53.2366 53.5237 53.7067 53.8709 54.0639 54.1758 54.4599 55.4300 55.5040 55.8800 56.2835 56.4335 56.8998 57.0066 57.2191 57.4719 57.7219 57.8961 58.3609 58.7313 58.8964 59.3008 59.4439 59.4736 59.9243 60.1227 60.4310 60.6922 60.7671 60.8984 61.2387 61.4421 61.6211 62.0139 62.1533 62.3885 62.4238 62.6631 62.9767 63.2635 63.3591 63.5621 63.8287 64.0972 64.8166 64.9775 65.1988 65.4851 66.0116 66.1106 66.3586 66.7213 66.9824 67.4853 67.6362 67.7334 67.9601 68.1962 68.3866 68.9962 69.0464 69.3846 69.6268 70.0204 70.1070 70.5474 70.7141 70.9570 71.0431 71.1403 71.4315 71.5294 71.8072 72.0649 72.1766 72.4731 72.6095 72.8720 72.9906 73.1504 73.2433 73.3991 73.6400 73.8172 74.1737 74.4529 74.7727 74.9396 75.0830 75.1907 75.2137 75.2813 75.6372 75.8658 75.9240 76.2200 76.5266 76.7836 76.9508 77.0836 77.2228 77.3122 77.4080 77.6406 77.8089 78.1896 78.3477 78.5940 78.6592 78.7398 78.9385 79.1153 79.2395 79.3582 79.5193 79.5915 79.6884 79.7127 80.0322 80.0623 80.3835 80.5411 80.6482 80.8793 80.9144 81.0158 81.2500 81.4443 81.5356 81.6021 81.7447 81.8819 82.0549 82.1648 82.5264 82.5821 82.6471 82.8922 83.0045 83.1694 83.3356 83.5278 83.5807 83.7608 83.8244 83.9534 84.1609 84.2407 84.3200 84.7055 84.7437 84.8431 85.0711 85.0766 85.3209 85.3939 85.5515 85.6328 85.8016 85.9697 86.1335 86.2422 86.2597 86.3975 86.4422 86.6112 86.7388 86.8186 86.8695 87.0736 87.1978 87.3800 87.6666 87.7179 87.8312 88.0760 88.1334 88.2501 88.6003 88.7553 88.8317 88.9622 89.0011 89.2104 89.3111 89.5685 89.6184 89.7105 89.7753 90.0264 90.1433 90.3406 90.4553 90.5443 90.5729 90.6759 90.8675 91.0081 91.0894 91.1608 91.5236 91.6772 91.7807 91.9634 92.0283 92.3310 92.3696 92.6312 92.8548 92.9344 93.0801 93.2561 93.4160 93.5281 93.6364 93.7756 93.9193 93.9623 94.2364 94.3591 94.4385 94.6356 94.6526 94.7628 94.8484 95.0554 95.2007 95.2489 95.3546 95.5216 95.5614 95.9275 96.0372 96.2998 96.4356 96.5843 96.7302 96.8157 96.9241 97.0448 97.2406 97.2622 97.4501 97.6782 98.0855 98.1719 98.1960 98.3409 98.5246 98.6580 98.8243 99.1371 99.2842 99.3289 99.4735 99.5971 99.6295 99.8083 99.9023 100.0025 100.2043 100.4362 100.5703 100.7514 100.8509 100.9334 101.1904 101.4550 101.5788 101.8042 101.9709 102.0440 102.1837 102.2776 102.4488 102.6162 102.7340 102.8872 103.2002 103.4773 103.6554 103.7404 103.7509 103.9100 104.1912 104.4125 104.5229 104.6848 104.7923 104.8550 104.9743 105.2008 105.4660 105.9455 105.9575 106.1125 106.2224 106.6425 106.9372 106.9998 107.1108 107.2935 107.4337 107.5148 107.9364 108.0074 108.2511 108.4438 108.7444 108.9495 109.0511 109.1594 109.2418 109.3322 109.4434 109.7090 109.7988 109.8963 110.0788 110.1849 110.3796 110.5319 110.6944 110.8267 110.9254 111.1383 111.1860 111.3084 111.6129 111.7603 111.8645 111.9336 112.1170 112.2673 112.4068 112.6687 112.7557 112.8526 113.0712 113.1228 113.3843 113.4891 113.6237 113.6773 113.9639 114.1102 114.5217 114.5605 114.6505 114.7592 114.8725 114.9431 115.0753 115.2448 115.2885 115.3564 115.5180 115.6426 115.7065 115.8512 116.0240 116.5438 116.7638 116.8464 116.9528 117.1064 117.2414 117.3835 117.4290 117.5521 117.6888 117.8614 117.9552 118.0520 118.1602 118.3113 118.4569 118.7391 118.9546 119.1204 119.2890 119.4880 119.5086 119.7460 119.9619 120.2630 120.3504 120.5441 120.6612 120.8846 121.3113 121.3684 121.5106 121.6722 122.1544 122.3229 122.4363 122.7035 122.9727 123.1101 123.2748 123.5208 123.8170 124.0249 124.2631 124.4601 124.6025 124.9992 125.2688 125.4058 125.6097 125.8931 126.1954 126.3293 126.3632 126.7143 126.8049 127.1008 127.2724 127.7327 127.7819 128.0407 128.1462 128.3670 128.5902 129.0005 129.1133 129.2865 129.5293 129.8142 130.0799 130.2183 130.3292 130.4537 130.5330 130.6927 130.9238 131.1831 131.4418 131.7608 131.9529 132.0926 132.3851 132.6498 132.8449 133.2557 133.4729 133.7051 134.0300 134.2182 134.3390 134.5047 134.5420 134.6858 134.8411 135.1464 135.5792 135.8122 135.9763 136.3508 136.9716 137.2899 137.6213 137.6589 138.0589 138.8719 139.0112 139.1888 139.3791 139.4914 139.6016 139.9747 140.1345 140.2076 140.3692 140.7102 140.8090 141.1086 141.1662 141.4171 141.6406 142.0189 142.0678 142.2177 142.8149 142.9373 143.0723 143.2795 143.3838 143.6248 143.8782 144.2785 144.4168 144.6405 144.8617 145.1083 145.2174 145.4253 145.4853 145.5978 145.8116 145.9647 146.1411 146.3202 146.5853 146.7430 146.8549 147.0243 147.3718 147.5034 148.1273 148.3266 148.3781 148.5217 148.7850 149.0383 149.2557 149.4394 149.6023 149.6720 149.7744 150.0269 150.1353 150.3639 150.6162 150.8223 150.9952 151.1477 151.2396 151.4247 151.4647 151.7591 152.0618 152.2287 152.4474 152.7725 152.9501 153.3532 153.6176 153.8607 154.1329 154.3858 154.5632 154.7779 154.8865 155.0840 155.5448 155.7181 155.8871 156.4070 156.4463 156.5172 156.7918 157.4234 157.5791 157.9194 157.9586 157.9891 158.0833 158.2159 158.9181 159.3652 159.5608 159.5932 160.0587 160.1491 160.2912 160.3777 160.6159 161.2602 161.3923 161.8629 163.1231 164.0430 164.8502 165.7128 166.6707 167.7417 168.9839 169.7381 171.4385 171.6546 172.7288 173.1857 175.7729 175.8545 176.1668 176.6108 177.6814 179.4291 180.2371 181.4980 181.9271 182.0957 186.7854 187.1176 187.5584 187.9326 188.2754 188.9386 192.2667 193.0990 193.3586 195.7110 196.1448 196.4949 196.5270 198.7270 199.1458 205.2994 206.9897 618.4015 621.7388 627.0652 630.6388 635.7711 638.3404 640.0028 640.4241 641.2758 642.4248 642.7079 643.5575 643.7742 645.0709 646.9118 647.6437 650.0329 650.3880 651.6773 902.4031 1198.9526 1199.6208 1200.8666 1209.2080 -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 -0.273592 -0.488516 -0.427421 -0.436293 -0.096531 0.132246 0.061567 -0.148122 -0.297911 -0.270128 -0.300054 0.446312 -0.044946 0.069655 -0.221852 -0.252506 -0.065065 -0.052435 -0.072175 -0.074822 -0.135424 -0.135160 0.330778 0.313601 0.105807 0.088262 0.102883 0.085767 0.099408 0.089241 0.099637 0.096795 0.121614 0.139679 0.137888 0.093523 0.094681 0.089156 0.089546 0.096326 0.096331 0.102249 0.093402 0.102313 0.094349 0.081204 0.078340 0.080955 0.079437 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 8.2736 8.4885 8.4274 8.4363 7.0965 5.8678 5.9384 6.1481 6.2979 6.2701 6.3001 5.5537 6.0449 5.9303 6.2219 6.2525 6.0651 6.0524 6.0722 6.0748 6.1354 6.1352 5.6692 5.6864 0.8942 0.9117 0.8971 0.9142 0.9006 0.9108 0.9004 0.9032 0.8784 0.8603 0.8621 0.9065 0.9053 0.9108 0.9105 0.9037 0.9037 0.8978 0.9066 0.8977 0.9057 0.9188 0.9217 0.9190 0.9206 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 -0.2736 -0.4885 -0.4274 -0.4363 -0.0965 0.1322 0.0616 -0.1481 -0.2979 -0.2701 -0.3001 0.4463 -0.0449 0.0697 -0.2219 -0.2525 -0.0651 -0.0524 -0.0722 -0.0748 -0.1354 -0.1352 0.3308 0.3136 0.1058 0.0883 0.1029 0.0858 0.0994 0.0892 0.0996 0.0968 0.1216 0.1397 0.1379 0.0935 0.0947 0.0892 0.0895 0.0963 0.0963 0.1022 0.0934 0.1023 0.0943 0.0812 0.0783 0.0810 0.0794 2.1066 2.0155 2.0804 2.0705 3.0849 3.6326 3.7442 3.8772 3.9040 3.9138 3.8530 4.1431 3.7522 3.9077 3.9215 3.9432 3.6704 3.7072 3.9133 3.9177 3.9171 3.9145 4.1841 4.1665 1.0194 1.0358 0.9990 1.0201 1.0026 1.0059 1.0010 1.0023 1.0101 0.9993 1.0118 0.9963 0.9959 1.0086 1.0106 0.9967 0.9974 1.0045 1.0163 1.0046 1.0148 1.0093 1.0065 1.0095 1.0066 2.1066 2.0155 2.0804 2.0705 3.0849 3.6326 3.7442 3.8772 3.9040 3.9138 3.8530 4.1431 3.7522 3.9077 3.9215 3.9432 3.6704 3.7072 3.9133 3.9177 3.9171 3.9145 4.1841 4.1665 1.0194 1.0358 0.9990 1.0201 1.0026 1.0059 1.0010 1.0023 1.0101 0.9993 1.0118 0.9963 0.9959 1.0086 1.0106 0.9967 0.9974 1.0045 1.0163 1.0046 1.0148 1.0093 1.0065 1.0095 1.0066 -0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 -0.0000 0.0000 1.1642 0.9027 1.8507 2.0125 1.9870 0.9224 1.1200 1.1046 0.8646 0.8859 0.9234 0.9476 0.9133 0.9682 1.0084 1.0488 1.0081 0.9998 0.9927 0.9896 0.9898 0.9892 0.9957 1.8492 0.9782 0.9660 0.9700 0.9737 0.9862 0.9814 0.9801 1.0001 1.0032 0.9833 0.9830 1.7430 0.9790 0.9402 0.9775 0.9563 0.9287 0.9819 1.0003 0.9291 0.9817 1.0010 0.9249 1.0070 1.0068 1.0070 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 -0.024109518 -1094.891892518486 -19.42314 19.81091 0.38777 -16.23744 14.63364 -1.60379 -4.49448 4.73801 0.24353 1.66788 4.23941