Orca 5.0.2 RELEASE 1 2 3 4 5 6 14s9p3d1f 11s6p2d1f 11s6p2d1f 11s6p2d1f 11s6p2d1f 5s2p1d 5s5p3d1f 5s3p2d1f 5s3p2d1f 5s3p2d1f 5s3p2d1f 3s2p1d 0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 S F O O O N N N C C C C C C C C C C C C C C C C C C H H H H H H H H H H H H H H H H H H H H H H H H 1 2 3 3 3 4 4 4 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 5 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 6 357.27430319999974 AuxInfo=1/0/N:13,14,23,24,16,26,22,21,9,20,12,25,19,18,10,11,15,17,2,7,8,6,3,5,4,1/E:(1,2)(3,4)/CRV:6.3,7.3,8.3,12.3,13.3,14.3,16.3,17.3,18.3,21.2,23.1,24.1/rA:50nSFO1OO1NNN2CCC3CCCC3CC3C3C3CC3C3CCC3C3HHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;;;;s6s9;s3s7s10;s7;s9;s9;s1s8s12;s12;s4s5s6;s1;s8s18;s4;s18;s19;s20;s20;s2s21;s22s25;s10;s9;s12;s13;s13;s13;s14;s14;s14;s6;s7;s16;s16;s16;s20;s21;s22;s23;s23;s23;s24;s24;s24;s26;/rC:2.4407,-2.8598,-.3905;6.6634,.0771,-.5168;-2.8155,-2.4412,-1.2024;-1.702,2.708,.873;-1.822,2.1953,-1.3226;-2.7216,.8501,.278;-1.2832,-1.4101,.0975;1.3031,-.6247,.1958;-4.7413,-.4261,-.3356;-3.2511,-.1606,-.6002;-2.4327,-1.4557,-.5857;-.3148,-2.4764,.1067;-5.5596,.8298,-.6065;-5.0021,-.9644,1.067;1.0542,-1.8659,-.0022;-.4314,-3.3457,1.3586;-2.0631,1.9468,-.1592;3.4395,-1.4521,-.2777;2.6407,-.3457,.0479;-.9857,3.9339,.6204;4.8101,-1.3416,-.4741;3.2288,.9101,.1852;-.165,4.2052,1.8625;-1.9637,5.0499,.314;5.3456,-.0811,-.331;4.589,1.0411,-.0057;-3.1587,.2143,-1.6235;-5.0491,-1.1889,-1.0543;-.4891,-3.102,-.7718;-6.6262,.6195,-.5143;-5.3862,1.2116,-1.6145;-5.3233,1.6306,.0969;-6.0568,-1.2173,1.1843;-4.768,-.2307,1.8423;-4.4296,-1.8694,1.2793;-2.9139,.7796,1.2669;-1.0313,-.5554,.5711;-.2545,-2.7577,2.2596;.2841,-4.1683,1.3401;-1.4308,-3.7765,1.4144;-.3139,3.7866,-.2283;5.4329,-2.1891,-.7289;2.6207,1.7696,.435;-.7967,4.3437,2.7418;.5348,3.3929,2.0646;.4182,5.1157,1.7244;-1.4203,5.9792,.1391;-2.6479,5.2144,1.1486;-2.5529,4.8425,-.5798;5.0716,2.0047,.0918; 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 1540 RIJ-COSX (HFX calculated with COS-X)) on IntName inp HFTyp RHF Charge 0 Mult 1 NEL 202 Dim 1153 ENuc 2563.9113912024 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 7.866e-06 Time for diagonalization 0.458 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.221 sec Total time needed 0.685 sec 16 9 8 8 8 7 7 7 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 1 357.27430319999974 AuxInfo=1/0/N:13,14,23,24,16,26,22,21,9,20,12,25,19,18,10,11,15,17,2,7,8,6,3,5,4,1/E:(1,2)(3,4)/CRV:6.3,7.3,8.3,12.3,13.3,14.3,16.3,17.3,18.3,21.2,23.1,24.1/rA:50nSFO1OO1NNN2CCC3CCCC3CC3C3C3CC3C3CCC3C3HHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;;;;s6s9;s3s7s10;s7;s9;s9;s1s8s12;s12;s4s5s6;s1;s8s18;s4;s18;s19;s20;s20;s2s21;s22s25;s10;s9;s12;s13;s13;s13;s14;s14;s14;s6;s7;s16;s16;s16;s20;s21;s22;s23;s23;s23;s24;s24;s24;s26;/rC:2.4407,-2.8598,-.3905;6.6634,.0771,-.5168;-2.8155,-2.4412,-1.2024;-1.702,2.708,.873;-1.822,2.1953,-1.3226;-2.7216,.8501,.278;-1.2832,-1.4101,.0975;1.3031,-.6247,.1958;-4.7413,-.4261,-.3356;-3.2511,-.1606,-.6002;-2.4327,-1.4557,-.5857;-.3148,-2.4764,.1067;-5.5596,.8298,-.6065;-5.0021,-.9644,1.067;1.0542,-1.8659,-.0022;-.4314,-3.3457,1.3586;-2.0631,1.9468,-.1592;3.4395,-1.4521,-.2777;2.6407,-.3457,.0479;-.9857,3.9339,.6204;4.8101,-1.3416,-.4741;3.2288,.9101,.1852;-.165,4.2052,1.8625;-1.9637,5.0499,.314;5.3456,-.0811,-.331;4.589,1.0411,-.0057;-3.1587,.2143,-1.6235;-5.0491,-1.1889,-1.0543;-.4891,-3.102,-.7718;-6.6262,.6195,-.5143;-5.3862,1.2116,-1.6145;-5.3233,1.6306,.0969;-6.0568,-1.2173,1.1843;-4.768,-.2307,1.8423;-4.4296,-1.8694,1.2793;-2.9139,.7796,1.2669;-1.0313,-.5554,.5711;-.2545,-2.7577,2.2596;.2841,-4.1683,1.3401;-1.4308,-3.7765,1.4144;-.3139,3.7866,-.2283;5.4329,-2.1891,-.7289;2.6207,1.7696,.435;-.7967,4.3437,2.7418;.5348,3.3929,2.0646;.4182,5.1157,1.7244;-1.4203,5.9792,.1391;-2.6479,5.2144,1.1486;-2.5529,4.8425,-.5798;5.0716,2.0047,.0918; 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 "1-OCTANOL" 357.27430319999974 AuxInfo=1/0/N:13,14,23,24,16,26,22,21,9,20,12,25,19,18,10,11,15,17,2,7,8,6,3,5,4,1/E:(1,2)(3,4)/CRV:6.3,7.3,8.3,12.3,13.3,14.3,16.3,17.3,18.3,21.2,23.1,24.1/rA:50nSFO1OO1NNN2CCC3CCCC3CC3C3C3CC3C3CCC3C3HHHHHHHHHHHHHHHHHHHHHHHH/rB:;;;;;;;;s6s9;s3s7s10;s7;s9;s9;s1s8s12;s12;s4s5s6;s1;s8s18;s4;s18;s19;s20;s20;s2s21;s22s25;s10;s9;s12;s13;s13;s13;s14;s14;s14;s6;s7;s16;s16;s16;s20;s21;s22;s23;s23;s23;s24;s24;s24;s26;/rC:2.4407,-2.8598,-.3905;6.6634,.0771,-.5168;-2.8155,-2.4412,-1.2024;-1.702,2.708,.873;-1.822,2.1953,-1.3226;-2.7216,.8501,.278;-1.2832,-1.4101,.0975;1.3031,-.6247,.1958;-4.7413,-.4261,-.3356;-3.2511,-.1606,-.6002;-2.4327,-1.4557,-.5857;-.3148,-2.4764,.1067;-5.5596,.8298,-.6065;-5.0021,-.9644,1.067;1.0542,-1.8659,-.0022;-.4314,-3.3457,1.3586;-2.0631,1.9468,-.1592;3.4395,-1.4521,-.2777;2.6407,-.3457,.0479;-.9857,3.9339,.6204;4.8101,-1.3416,-.4741;3.2288,.9101,.1852;-.165,4.2052,1.8625;-1.9637,5.0499,.314;5.3456,-.0811,-.331;4.589,1.0411,-.0057;-3.1587,.2143,-1.6235;-5.0491,-1.1889,-1.0543;-.4891,-3.102,-.7718;-6.6262,.6195,-.5143;-5.3862,1.2116,-1.6145;-5.3233,1.6306,.0969;-6.0568,-1.2173,1.1843;-4.768,-.2307,1.8423;-4.4296,-1.8694,1.2793;-2.9139,.7796,1.2669;-1.0313,-.5554,.5711;-.2545,-2.7577,2.2596;.2841,-4.1683,1.3401;-1.4308,-3.7765,1.4144;-.3139,3.7866,-.2283;5.4329,-2.1891,-.7289;2.6207,1.7696,.435;-.7967,4.3437,2.7418;.5348,3.3929,2.0646;.4182,5.1157,1.7244;-1.4203,5.9792,.1391;-2.6479,5.2144,1.1486;-2.5529,4.8425,-.5798;5.0716,2.0047,.0918; Epsilon 9.8629 Refrac 1.4295 Rsolv 1.3000 Surface type GAUSSIAN VDW Epsilon function type CPCM S F O N C H 2.4900 1.7300 1.6280 1.8900 1.8500 1.2000 Solvent: 1-OCTANOL Soln 1.4295 Soln25 1.4279 Sola 0.3700 Solb 0.4800 Solg 39.0100 Solc 0.0000 Solh 0.0000 Calculating surface done! ( 0.0s) GEPOL surface points 2873 GEPOL Volume 2678.1923 GEPOL Surface-area 1508.3903 Calculating surface distance matrix done! ( 0.1s) Performing Cholesky decomposition & store done! ( 0.7s) Overall time for CPCM initialization 0.8s -1588.57958488 2563.91139120 -4152.49097608 -7271.31038687 3118.81941078 -0.03803577 -3171.38543662 1582.80585174 2.00364778 100.999906908318 100.999906908318 201.999813816637 -132.199077406716 0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 217 218 219 220 221 222 223 224 225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 245 246 247 248 249 250 251 252 253 254 255 256 257 258 259 260 261 262 263 264 265 266 267 268 269 270 271 272 273 274 275 276 277 278 279 280 281 282 283 284 285 286 287 288 289 290 291 292 293 294 295 296 297 298 299 300 301 302 303 304 305 306 307 308 309 310 311 312 313 314 315 316 317 318 319 320 321 322 323 324 325 326 327 328 329 330 331 332 333 334 335 336 337 338 339 340 341 342 343 344 345 346 347 348 349 350 351 352 353 354 355 356 357 358 359 360 361 362 363 364 365 366 367 368 369 370 371 372 373 374 375 376 377 378 379 380 381 382 383 384 385 386 387 388 389 390 391 392 393 394 395 396 397 398 399 400 401 402 403 404 405 406 407 408 409 410 411 412 413 414 415 416 417 418 419 420 421 422 423 424 425 426 427 428 429 430 431 432 433 434 435 436 437 438 439 440 441 442 443 444 445 446 447 448 449 450 451 452 453 454 455 456 457 458 459 460 461 462 463 464 465 466 467 468 469 470 471 472 473 474 475 476 477 478 479 480 481 482 483 484 485 486 487 488 489 490 491 492 493 494 495 496 497 498 499 500 501 502 503 504 505 506 507 508 509 510 511 512 513 514 515 516 517 518 519 520 521 522 523 524 525 526 527 528 529 530 531 532 533 534 535 536 537 538 539 540 541 542 543 544 545 546 547 548 549 550 551 552 553 554 555 556 557 558 559 560 561 562 563 564 565 566 567 568 569 570 571 572 573 574 575 576 577 578 579 580 581 582 583 584 585 586 587 588 589 590 591 592 593 594 595 596 597 598 599 600 601 602 603 604 605 606 607 608 609 610 611 612 613 614 615 616 617 618 619 620 621 622 623 624 625 626 627 628 629 630 631 632 633 634 635 636 637 638 639 640 641 642 643 644 645 646 647 648 649 650 651 652 653 654 655 656 657 658 659 660 661 662 663 664 665 666 667 668 669 670 671 672 673 674 675 676 677 678 679 680 681 682 683 684 685 686 687 688 689 690 691 692 693 694 695 696 697 698 699 700 701 702 703 704 705 706 707 708 709 710 711 712 713 714 715 716 717 718 719 720 721 722 723 724 725 726 727 728 729 730 731 732 733 734 735 736 737 738 739 740 741 742 743 744 745 746 747 748 749 750 751 752 753 754 755 756 757 758 759 760 761 762 763 764 765 766 767 768 769 770 771 772 773 774 775 776 777 778 779 780 781 782 783 784 785 786 787 788 789 790 791 792 793 794 795 796 797 798 799 800 801 802 803 804 805 806 807 808 809 810 811 812 813 814 815 816 817 818 819 820 821 822 823 824 825 826 827 828 829 830 831 832 833 834 835 836 837 838 839 840 841 842 843 844 845 846 847 848 849 850 851 852 853 854 855 856 857 858 859 860 861 862 863 864 865 866 867 868 869 870 871 872 873 874 875 876 877 878 879 880 881 882 883 884 885 886 887 888 889 890 891 892 893 894 895 896 897 898 899 900 901 902 903 904 905 906 907 908 909 910 911 912 913 914 915 916 917 918 919 920 921 922 923 924 925 926 927 928 929 930 931 932 933 934 935 936 937 938 939 940 941 942 943 944 945 946 947 948 949 950 951 952 953 954 955 956 957 958 959 960 961 962 963 964 965 966 967 968 969 970 971 972 973 974 975 976 977 978 979 980 981 982 983 984 985 986 987 988 989 990 991 992 993 994 995 996 997 998 999 1000 1001 1002 1003 1004 1005 1006 1007 1008 1009 1010 1011 1012 1013 1014 1015 1016 1017 1018 1019 1020 1021 1022 1023 1024 1025 1026 1027 1028 1029 1030 1031 1032 1033 1034 1035 1036 1037 1038 1039 1040 1041 1042 1043 1044 1045 1046 1047 1048 1049 1050 1051 1052 1053 1054 1055 1056 1057 1058 1059 1060 1061 1062 1063 1064 1065 1066 1067 1068 1069 1070 1071 1072 1073 1074 1075 1076 1077 1078 1079 1080 1081 1082 1083 1084 1085 1086 1087 1088 1089 1090 1091 1092 1093 1094 1095 1096 1097 1098 1099 1100 1101 1102 1103 1104 1105 1106 1107 1108 1109 1110 1111 1112 1113 1114 1115 1116 1117 1118 1119 1120 1121 1122 1123 1124 1125 1126 1127 1128 1129 1130 1131 1132 1133 1134 1135 1136 1137 1138 1139 1140 1141 1142 1143 1144 1145 1146 1147 1148 1149 1150 1151 1152 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -2421.5540 -674.9167 -524.4578 -522.7139 -522.5533 -393.1955 -393.1764 -392.8092 -283.8442 -282.5766 -282.2658 -282.0066 -281.2996 -281.2445 -281.0903 -280.9070 -280.8752 -280.2346 -280.1622 -280.0366 -279.7819 -279.4883 -279.2199 -279.1798 -279.1468 -279.0721 -220.0757 -164.3807 -164.2716 -164.2010 -36.8249 -33.6247 -31.7660 -30.9893 -30.1804 -29.0115 -28.5103 -26.9288 -25.4614 -25.3406 -24.6916 -24.5826 -23.7155 -23.1955 -22.5577 -21.8899 -21.6855 -21.1983 -20.3261 -20.0203 -19.9191 -19.2051 -18.8472 -18.7843 -18.3114 -17.9354 -17.5327 -17.4331 -16.8454 -16.6125 -16.1365 -15.9753 -15.9209 -15.6546 -15.2888 -15.2217 -15.1392 -15.0159 -14.8792 -14.8401 -14.6195 -14.2614 -14.1507 -14.1251 -14.0657 -13.8305 -13.4471 -13.4376 -13.1601 -13.1096 -13.0793 -12.9482 -12.8135 -12.6775 -12.5005 -12.2893 -12.0072 -11.9757 -11.7498 -11.6161 -11.5931 -11.5052 -11.2002 -10.8902 -10.6589 -10.5533 -10.5177 -9.8595 -9.3313 -9.0480 -8.8245 0.8330 1.2926 2.1046 2.5964 2.7024 2.9178 3.4360 3.4843 3.6878 3.9131 4.0892 4.2622 4.4071 4.4909 4.5939 4.6951 4.7998 4.8602 4.9620 5.0896 5.1768 5.2501 5.3302 5.4041 5.4727 5.5995 5.7618 5.8507 5.9986 6.0907 6.2334 6.2970 6.4270 6.5042 6.5730 6.6351 6.6573 6.7456 6.9530 6.9691 7.1134 7.2768 7.3261 7.4041 7.5939 7.6680 7.7551 7.8605 7.9164 8.1163 8.1893 8.3388 8.4120 8.5790 8.7068 8.8077 8.8428 8.9347 9.1209 9.1778 9.2515 9.3371 9.4483 9.5582 9.9020 10.0001 10.0249 10.2612 10.3428 10.4776 10.5715 10.7847 10.8906 11.0102 11.0243 11.1131 11.1983 11.3408 11.3563 11.5611 11.6574 11.7543 11.7683 11.8639 12.0449 12.1013 12.3615 12.4503 12.4831 12.7183 12.8000 12.9308 12.9890 13.1463 13.1981 13.2859 13.3128 13.4294 13.5179 13.5644 13.7169 13.7751 13.8528 13.9620 14.0088 14.1315 14.1767 14.2756 14.3701 14.4173 14.4803 14.5213 14.5534 14.5853 14.7466 14.8563 14.9054 14.9704 15.1058 15.1478 15.2914 15.3496 15.3694 15.4173 15.5599 15.7223 15.8160 15.8447 15.9886 16.0091 16.1465 16.3128 16.3416 16.5002 16.5752 16.7711 16.9775 17.0425 17.1466 17.4127 17.5449 17.7097 17.8328 17.8763 18.0089 18.0777 18.2274 18.3266 18.4922 18.5347 18.6995 18.8081 18.9494 18.9796 19.3611 19.3746 19.6018 19.7228 19.9107 20.0804 20.2314 20.3875 20.4490 20.5550 20.6475 20.6957 20.8108 20.9758 21.0768 21.3228 21.4101 21.6713 21.8718 21.9880 22.1927 22.3262 22.4535 22.6683 22.7163 22.8330 22.9086 23.1933 23.2786 23.4677 23.6161 23.7950 23.8730 23.9582 24.0461 24.2070 24.3689 24.5745 24.6276 24.8366 25.0324 25.2640 25.3426 25.5225 25.7510 25.8891 26.1199 26.2747 26.3465 26.4449 26.5321 26.6186 26.8518 26.8758 27.0953 27.4015 27.4572 27.5570 27.6164 27.7976 27.8866 27.9664 28.0645 28.2018 28.3109 28.3989 28.4678 28.5425 28.5790 28.7257 29.0220 29.0951 29.2334 29.2702 29.4125 29.5437 29.6538 29.8038 29.9719 30.0998 30.3356 30.3734 30.5930 30.7192 30.8408 31.0603 31.1132 31.1487 31.2628 31.4516 31.6171 31.7169 31.7988 31.9233 32.0473 32.2748 32.3857 32.6692 32.9476 33.0913 33.2496 33.3596 33.5377 33.5618 33.9712 34.0797 34.1729 34.3790 34.4324 34.5392 34.6644 34.8728 35.0721 35.3450 35.3911 35.6235 35.6595 35.6777 35.8588 36.0577 36.1749 36.2874 36.3666 36.5919 36.8045 36.8932 37.0819 37.2446 37.2763 37.5376 37.6285 37.7513 37.9359 38.0012 38.2082 38.2426 38.3031 38.6448 38.7488 38.8808 38.9465 39.2224 39.4518 39.6013 39.6794 39.8524 39.9072 40.1074 40.3688 40.4968 40.5806 40.7379 40.8506 41.0197 41.0624 41.1182 41.2767 41.3381 41.5791 41.6691 41.8146 42.0198 42.0851 42.3336 42.3564 42.4892 42.6292 42.7274 42.8734 42.9149 42.9953 43.1770 43.3665 43.4658 43.5183 43.5950 43.7806 43.8625 44.0072 44.1398 44.2909 44.4433 44.5328 44.6195 44.6616 44.7851 44.8337 45.0626 45.1309 45.2560 45.3624 45.4011 45.5390 45.7889 45.9058 45.9389 46.0638 46.1328 46.3749 46.5944 46.8725 46.9180 47.0146 47.2608 47.2936 47.3485 47.5676 47.7077 47.7412 47.9470 48.0390 48.2606 48.3963 48.5376 48.6493 48.7379 48.9659 49.2261 49.3666 49.7538 49.8907 50.1514 50.2250 50.4369 50.6534 50.9209 51.0077 51.1444 51.4135 51.5232 51.7309 52.0358 52.3003 52.4150 52.8231 52.9763 53.3445 53.4721 53.5979 53.7447 54.1669 54.2357 54.6957 54.9536 55.1772 55.5394 55.9714 56.2994 56.3958 56.6646 57.0227 57.2560 57.2960 57.4750 57.5711 57.8109 57.9426 58.2132 58.4157 58.4603 58.6739 58.9363 59.2083 59.5066 59.5936 59.7313 59.9795 60.0358 60.2826 60.5640 60.8943 60.9876 61.4982 61.8241 61.9115 62.1476 62.2263 62.3877 62.6176 63.0768 63.4065 63.5368 63.7875 63.8612 63.9386 64.4871 64.7417 64.9045 64.9100 65.2954 65.3552 65.4736 65.8122 66.2106 66.3611 66.6307 66.7478 67.0066 67.1732 67.5135 67.6896 67.7551 68.0860 68.8540 69.0063 69.2960 69.3815 69.8943 70.0384 70.0855 70.4931 70.5808 71.0138 71.2355 71.3363 71.6944 71.7240 71.9080 72.0595 72.2716 72.3672 72.4566 72.6883 72.8702 73.0239 73.2383 73.3126 73.7820 74.2820 74.5989 74.9420 75.0217 75.3247 75.5591 75.7148 75.8375 75.8725 76.0297 76.3580 76.6890 77.0968 77.2001 77.4772 77.5443 77.8952 77.9847 78.1313 78.4201 78.6113 78.8055 78.9687 79.0465 79.1701 79.2387 79.3135 79.3870 79.4669 79.5841 79.6890 79.7647 79.8324 79.9466 80.0597 80.2108 80.3661 80.5670 80.6854 80.8093 80.9461 81.1462 81.2969 81.3141 81.5674 81.7339 81.9099 82.0056 82.1162 82.3703 82.4100 82.6077 82.6269 82.7525 82.9332 83.0860 83.3030 83.6938 83.8736 83.9427 84.0630 84.2208 84.3054 84.3295 84.5864 84.6305 84.6918 84.8978 85.0354 85.0958 85.1617 85.3531 85.4282 85.6205 85.6949 85.7114 85.8551 85.9869 86.1467 86.2366 86.4743 86.7369 86.7941 87.0041 87.2426 87.2520 87.3794 87.5293 87.6768 87.7982 87.8935 87.9832 88.3094 88.3840 88.4924 88.4959 88.7049 88.8577 88.9972 89.0773 89.1699 89.2282 89.2739 89.4599 89.5210 89.6504 89.8081 90.1525 90.2961 90.3145 90.5306 90.5642 90.7746 91.0296 91.2766 91.3928 91.4609 91.6036 91.7374 91.9177 91.9749 92.0624 92.2000 92.2889 92.4722 92.6995 93.0260 93.1764 93.3124 93.4319 93.4791 93.6985 93.8252 93.8901 93.9569 94.1305 94.2435 94.2786 94.4360 94.5077 94.6257 94.7104 94.8781 95.0693 95.1811 95.2783 95.3868 95.4731 95.7866 95.9655 96.2122 96.4592 96.6587 96.8301 96.8940 96.9921 97.0724 97.2711 97.3265 97.4708 97.5881 97.7673 97.8479 97.9028 98.0848 98.3040 98.3825 98.5258 98.7965 98.9269 99.1237 99.1888 99.3808 99.4859 99.7144 99.7421 99.8765 100.0574 100.2393 100.3914 100.4325 100.6309 100.8036 100.9494 101.1055 101.2071 101.4373 101.6255 101.8400 102.0845 102.1915 102.3442 102.5715 102.7520 102.9660 103.1048 103.2915 103.5200 103.7515 103.8644 103.9244 104.0218 104.2018 104.5581 104.5898 104.6714 104.7847 104.9885 105.0983 105.4465 105.6160 105.8037 105.8954 106.0019 106.1306 106.3923 106.6628 106.8109 106.9561 106.9840 107.0725 107.2368 107.4894 107.7535 107.8070 107.9263 108.2948 108.4012 108.5409 108.7054 108.7434 108.8846 109.2263 109.3293 109.3299 109.7754 109.8582 110.0615 110.2015 110.5233 110.6102 110.8221 110.9048 111.0760 111.2132 111.2393 111.4780 111.5242 111.8109 112.0374 112.1721 112.3768 112.4921 112.6345 112.7819 113.0674 113.2164 113.4002 113.5072 113.5995 113.7435 113.8148 113.9679 114.0711 114.2244 114.3842 114.5510 114.6311 114.7473 114.9266 115.0060 115.1338 115.2743 115.4361 115.5240 115.6306 115.7798 115.8974 116.2753 116.4042 116.4660 116.6334 116.7408 116.8253 116.9395 117.0513 117.2823 117.2888 117.4907 117.7307 117.9908 118.1837 118.3020 118.3827 118.6438 118.9389 119.0077 119.3210 119.5985 119.7157 119.9346 120.0093 120.1680 120.2229 120.3320 120.6171 120.6738 120.8872 121.1096 121.4615 121.7034 121.7350 121.9502 122.0237 122.1817 122.2343 122.5627 122.6520 122.7134 122.9798 123.1300 123.4334 123.7688 124.1106 124.3632 124.7219 124.8738 125.3109 125.6317 125.8854 126.0495 126.2103 126.3785 126.7381 126.8889 127.1597 127.2720 127.6848 128.0590 128.1777 128.4047 128.6659 128.6903 129.1899 129.4422 129.6374 129.7021 130.0467 130.1809 130.3668 130.5693 130.7489 131.0935 131.1341 131.3047 131.3673 131.7848 131.9886 132.2448 132.3008 132.4878 132.7979 132.9353 133.0568 133.2900 133.7445 134.0947 134.1344 134.4840 134.7164 134.9785 135.2267 135.2968 135.5489 135.7479 136.1345 136.2176 136.2695 136.5193 136.6649 136.8824 137.0881 137.4071 137.6851 137.8984 138.3300 139.0066 139.2508 139.7490 139.9556 140.2291 140.5504 140.6947 140.8035 141.0993 141.3402 141.8703 142.0744 142.3525 142.4309 142.6000 142.7747 143.3837 143.5052 143.6789 143.9455 144.1387 144.2591 144.4891 144.6028 145.0097 145.2603 145.4651 145.5096 145.6233 145.9381 146.0506 146.2455 146.4773 147.0412 147.2065 147.2897 147.5511 147.7217 147.7564 147.8744 148.0256 148.2402 148.6010 148.7610 148.8507 148.9725 149.1895 149.3401 149.4664 149.5906 149.7936 150.0080 150.3592 150.6266 150.7358 150.9150 150.9981 151.7584 151.8548 152.0642 152.1968 152.4906 152.7205 152.8539 153.1381 153.3120 153.5419 153.6868 153.8416 153.9678 154.0284 154.2560 154.3292 155.0398 155.3468 155.4755 155.6298 155.9581 156.1983 156.4657 156.8813 157.1866 157.3514 157.5506 157.6685 157.7955 158.0781 158.1383 158.4838 158.6191 158.7993 158.9038 159.1860 159.7070 159.8447 160.5726 160.7157 160.9966 161.9263 162.4711 162.6278 163.1644 163.9027 164.4471 165.9176 166.2137 167.6892 168.0072 168.6760 168.9144 170.3046 171.1519 172.7227 173.4719 175.6171 177.3172 177.4373 177.9300 178.5386 178.7295 179.2981 181.3608 181.4578 184.2736 185.0801 186.1651 186.4342 186.9997 187.3294 188.1842 189.3973 189.4498 189.8127 189.8816 190.2089 192.6863 193.8076 194.4634 194.6330 195.8873 196.1214 196.1558 198.9866 199.8470 200.0232 204.7244 206.1220 206.7475 208.2610 211.6968 229.6838 235.3176 240.9351 244.9030 247.7348 248.0573 261.1102 262.0642 562.8911 615.8066 626.1792 630.0196 631.4558 633.0863 633.6072 634.1630 634.5624 636.5055 637.4233 642.5779 645.8141 646.2126 647.1802 647.5058 648.6517 649.2918 653.0752 890.2819 903.7940 906.8318 1198.6678 1200.6715 1212.4673 1562.9564 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 49 S F O O O N N N C C C C C C C C C C C C C C C C C C H H H H H H H H H H H H H H H H H H H H H H H H 0.053882 -0.218465 -0.532892 -0.335936 -0.521947 -0.273387 -0.171604 -0.336059 0.067503 0.096396 0.282842 0.074122 -0.313474 -0.296969 0.177830 -0.260934 0.520916 -0.040382 0.186394 0.157509 -0.200656 -0.262041 -0.254855 -0.261578 0.286088 -0.148472 0.110981 0.042095 0.090600 0.101448 0.098174 0.082560 0.098402 0.081052 0.096302 0.181355 0.176686 0.102639 0.092741 0.101739 0.063931 0.146792 0.153098 0.092783 0.092490 0.091032 0.096101 0.088256 0.095075 0.149839 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 S F O O O N N N 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 15.9461 9.2185 8.5329 8.3359 8.5219 7.2734 7.1716 7.3361 5.9325 5.9036 5.7172 5.9259 6.3135 6.2970 5.8222 6.2609 5.4791 6.0404 5.8136 5.8425 6.2007 6.2620 6.2549 6.2616 5.7139 6.1485 0.8890 0.9579 0.9094 0.8986 0.9018 0.9174 0.9016 0.9189 0.9037 0.8186 0.8233 0.8974 0.9073 0.8983 0.9361 0.8532 0.8469 0.9072 0.9075 0.9090 0.9039 0.9117 0.9049 0.8502 16.0000 9.0000 8.0000 8.0000 8.0000 7.0000 7.0000 7.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 6.0000 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 0.0539 -0.2185 -0.5329 -0.3359 -0.5219 -0.2734 -0.1716 -0.3361 0.0675 0.0964 0.2828 0.0741 -0.3135 -0.2970 0.1778 -0.2609 0.5209 -0.0404 0.1864 0.1575 -0.2007 -0.2620 -0.2549 -0.2616 0.2861 -0.1485 0.1110 0.0421 0.0906 0.1014 0.0982 0.0826 0.0984 0.0811 0.0963 0.1814 0.1767 0.1026 0.0927 0.1017 0.0639 0.1468 0.1531 0.0928 0.0925 0.0910 0.0961 0.0883 0.0951 0.1498 2.6699 1.0592 1.9888 2.0748 1.9876 3.1643 3.1958 3.0547 3.8294 3.8111 4.2725 3.8621 3.9438 3.9386 3.9763 3.9370 4.3098 3.8594 3.8234 3.8282 3.8869 3.9954 3.9334 3.9113 3.9305 3.8712 1.0389 1.0402 1.0442 1.0040 1.0030 1.0088 1.0039 1.0045 1.0086 1.0196 1.0467 1.0041 1.0113 1.0076 1.0242 1.0037 1.0033 1.0074 1.0089 1.0057 1.0064 1.0072 1.0166 0.9979 2.6699 1.0592 1.9888 2.0748 1.9876 3.1643 3.1958 3.0547 3.8294 3.8111 4.2725 3.8621 3.9438 3.9386 3.9763 3.9370 4.3098 3.8594 3.8234 3.8282 3.8869 3.9954 3.9334 3.9113 3.9305 3.8712 1.0389 1.0402 1.0442 1.0040 1.0030 1.0088 1.0039 1.0045 1.0086 1.0196 1.0467 1.0041 1.0113 1.0076 1.0242 1.0037 1.0033 1.0074 1.0089 1.0057 1.0064 1.0072 1.0166 0.9979 -0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -0.0000 -0.0000 1.2409 1.2120 0.9978 1.8574 1.1735 0.8497 1.8263 0.8612 1.2453 0.9579 1.3092 0.8948 0.9272 1.6678 1.2074 0.9254 0.9332 0.9472 1.0041 0.9829 0.9798 0.9801 0.9202 1.0054 0.9975 0.9935 0.9896 0.9927 0.9824 0.9900 0.9816 0.9891 0.9881 1.3064 1.2477 1.2914 0.9585 0.9623 1.0063 0.1062 1.4907 0.9724 1.4697 0.9689 0.9873 0.9933 0.9868 0.9878 0.9848 0.9870 1.3475 0.9875 0 14 0 17 1 24 2 10 3 16 3 19 4 16 5 9 5 16 5 35 6 10 6 11 6 36 7 14 7 18 8 9 8 12 8 13 8 27 9 10 9 26 11 14 11 15 11 28 12 29 12 30 12 31 13 32 13 33 13 34 15 37 15 38 15 39 17 18 17 20 18 21 19 22 19 23 19 40 20 21 20 24 20 41 21 25 21 42 22 43 22 44 22 45 23 46 23 47 23 48 24 25 25 49 -0.025061215 -1588.604646095162 -44.33689 44.67585 0.33896 18.62717 -17.98326 0.64392 12.29217 -9.95147 2.34070 2.45121 6.23047