0NR Converted by convert_cif2sdf.py 2024/03/29 11:09:15 76 82 0 0 0 0 0 0 0 0999 V2000 -4.2443 -2.6107 0.8742 C 0 0 0 0 0 -4.6521 -3.6762 1.6811 C 0 0 0 0 0 -5.4062 -3.3882 2.8036 C 0 0 0 0 0 -5.7273 -2.0691 3.0880 C 0 0 0 0 0 -5.3327 -1.0803 2.3139 N 0 0 0 0 0 -4.6067 -1.2957 1.2246 C 0 0 0 0 0 -4.2026 -0.2507 0.4282 N 0 0 0 0 0 -4.5660 1.0528 0.7813 C 0 0 0 0 0 -3.4545 -0.4516 -0.6972 C 0 0 0 0 0 -3.0664 -1.6874 -1.0997 C 0 0 0 0 0 -2.2425 -1.8516 -2.3505 C 0 0 0 0 0 -0.7813 -1.9127 -1.9845 C 0 0 0 0 0 -3.4344 -2.8275 -0.3346 C 0 0 0 0 0 -3.0985 -3.9491 -0.6738 O 0 0 0 0 0 -5.7313 1.6127 0.2713 C 0 0 0 0 0 -6.0868 2.9005 0.6211 C 0 0 0 0 0 -5.2859 3.6316 1.4785 C 0 0 0 0 0 -4.1265 3.0778 1.9884 C 0 0 0 0 0 -3.7669 1.7890 1.6464 C 0 0 0 0 0 -3.0537 0.7222 -1.5073 C 0 0 0 0 0 -2.1515 1.4414 -1.1300 O 0 0 0 0 0 -3.6914 0.9920 -2.6631 O 0 0 0 0 0 -3.2457 2.1579 -3.4048 C 0 0 0 0 0 -0.1902 -3.1325 -1.7117 C 0 0 0 0 0 1.1471 -3.1951 -1.3770 C 0 0 0 0 0 1.9033 -2.0241 -1.3135 C 0 0 0 0 0 1.3001 -0.7957 -1.5899 C 0 0 0 0 0 -0.0364 -0.7477 -1.9286 C 0 0 0 0 0 3.3363 -2.0841 -0.9547 C 0 0 0 0 0 3.8578 -3.1544 -0.7135 O 0 0 0 0 0 4.0634 -0.9509 -0.8942 N 0 0 0 0 0 5.4833 -1.0095 -0.5390 C 0 0 0 0 0 5.6279 -1.0102 0.9839 C 0 0 0 0 0 5.0122 0.2696 1.5554 C 0 0 0 0 0 5.7343 1.4865 0.9742 C 0 0 0 0 0 5.5897 1.4863 -0.5488 C 0 0 0 0 0 6.2054 0.2074 -1.1202 C 0 0 0 0 0 7.2176 1.4246 1.3455 C 0 0 0 0 0 7.8333 0.1458 0.7741 C 0 0 0 0 0 7.6887 0.1455 -0.7488 C 0 0 0 0 0 7.1112 -1.0711 1.3553 C 0 0 0 0 0 9.2572 0.0860 1.1312 N 0 0 0 0 0 -4.3876 -4.6944 1.4346 H 0 0 0 0 0 -5.7419 -4.1819 3.4527 H 0 0 0 0 0 -6.3159 -1.8474 3.9657 H 0 0 0 0 0 -2.5281 -2.7739 -2.8566 H 0 0 0 0 0 -2.4153 -1.0044 -3.0136 H 0 0 0 0 0 -6.3570 1.0426 -0.3998 H 0 0 0 0 0 -6.9922 3.3360 0.2245 H 0 0 0 0 0 -5.5667 4.6385 1.7513 H 0 0 0 0 0 -3.5029 3.6511 2.6580 H 0 0 0 0 0 -2.8633 1.3549 2.0483 H 0 0 0 0 0 -3.8400 2.2599 -4.3129 H 0 0 0 0 0 -3.3664 3.0489 -2.7891 H 0 0 0 0 0 -2.1945 2.0399 -3.6706 H 0 0 0 0 0 -0.7756 -4.0390 -1.7602 H 0 0 0 0 0 1.6070 -4.1487 -1.1636 H 0 0 0 0 0 1.8795 0.1141 -1.5429 H 0 0 0 0 0 -0.5042 0.2020 -2.1432 H 0 0 0 0 0 3.6470 -0.0959 -1.0870 H 0 0 0 0 0 5.9217 -1.9214 -0.9460 H 0 0 0 0 0 5.1138 -1.8772 1.3984 H 0 0 0 0 0 3.9558 0.3131 1.2904 H 0 0 0 0 0 5.1151 0.2693 2.6407 H 0 0 0 0 0 5.2959 2.3974 1.3810 H 0 0 0 0 0 4.5333 1.5307 -0.8137 H 0 0 0 0 0 6.1038 2.3532 -0.9633 H 0 0 0 0 0 6.1025 0.2077 -2.2045 H 0 0 0 0 0 7.7317 2.2916 0.9310 H 0 0 0 0 0 7.3205 1.4242 2.4308 H 0 0 0 0 0 8.1271 -0.7654 -1.1557 H 0 0 0 0 0 8.2028 1.0124 -1.1624 H 0 0 0 0 0 7.2141 -1.0715 2.4406 H 0 0 0 0 0 7.5496 -1.9831 0.9493 H 0 0 0 0 0 9.3789 0.0851 2.1322 H 0 0 0 0 0 9.7014 -0.7165 0.7117 H 0 0 0 0 0 42 39 1 0 0 0 41 39 1 0 0 0 41 33 1 0 0 0 38 39 1 0 0 0 38 35 1 0 0 0 39 40 1 0 0 0 34 33 1 0 0 0 34 35 1 0 0 0 33 32 1 0 0 0 35 36 1 0 0 0 40 37 1 0 0 0 32 37 1 0 0 0 32 31 1 0 0 0 36 37 1 0 0 0 31 29 1 0 0 0 29 30 2 0 0 0 29 26 1 0 0 0 26 25 2 0 0 0 26 27 1 0 0 0 25 24 1 0 0 0 27 28 2 0 0 0 24 12 2 0 0 0 28 12 1 0 0 0 12 11 1 0 0 0 11 10 1 0 0 0 14 13 2 0 0 0 13 10 1 0 0 0 13 1 1 0 0 0 10 9 2 0 0 0 2 1 2 0 0 0 2 3 1 0 0 0 1 6 1 0 0 0 9 20 1 0 0 0 9 7 1 0 0 0 22 20 1 0 0 0 22 23 1 0 0 0 20 21 2 0 0 0 3 4 2 0 0 0 6 7 1 0 0 0 6 5 2 0 0 0 7 8 1 0 0 0 4 5 1 0 0 0 8 15 2 0 0 0 8 19 1 0 0 0 15 16 1 0 0 0 19 18 2 0 0 0 16 17 2 0 0 0 18 17 1 0 0 0 2 43 1 0 0 0 3 44 1 0 0 0 4 45 1 0 0 0 11 46 1 0 0 0 11 47 1 0 0 0 15 48 1 0 0 0 16 49 1 0 0 0 17 50 1 0 0 0 18 51 1 0 0 0 19 52 1 0 0 0 23 53 1 0 0 0 23 54 1 0 0 0 23 55 1 0 0 0 24 56 1 0 0 0 25 57 1 0 0 0 27 58 1 0 0 0 28 59 1 0 0 0 31 60 1 0 0 0 32 61 1 0 0 0 33 62 1 0 0 0 34 63 1 0 0 0 34 64 1 0 0 0 35 65 1 0 0 0 36 66 1 0 0 0 36 67 1 0 0 0 37 68 1 0 0 0 38 69 1 0 0 0 38 70 1 0 0 0 40 71 1 0 0 0 40 72 1 0 0 0 41 73 1 0 0 0 41 74 1 0 0 0 42 75 1 0 0 0 42 76 1 0 0 0 M END $$$$