FCE Converted by convert_cif2sdf.py 2024/03/29 11:09:15 91 96 0 0 0 0 0 0 0 0999 V2000 63.5802 59.8084 0.6491 C 0 0 0 0 0 62.3641 61.5331 1.7840 N 0 0 0 0 0 63.6303 59.7541 -0.5625 O 0 0 0 0 0 68.6262 62.9256 -0.0666 C 0 0 0 0 0 68.0424 60.8533 1.1294 N 0 0 0 0 0 68.4490 63.3555 -1.1335 O 0 0 0 0 0 58.1002 61.0697 -1.3670 C 0 0 0 0 0 62.5945 64.0998 2.1069 N 0 0 0 0 0 58.5715 62.1634 -2.1542 O 0 0 0 0 0 62.0609 61.9830 3.0039 C 0 0 0 0 0 66.0609 64.5805 0.8286 N 0 0 0 0 0 61.8562 61.2916 3.9275 O 0 0 0 0 0 66.7117 60.8501 1.0852 C 0 0 0 0 0 58.5259 60.9938 -0.1076 N 0 0 0 0 0 66.1348 61.8603 1.2005 O 0 0 0 0 0 58.6013 65.5596 0.3051 C 0 0 0 0 0 59.8388 65.4158 0.7681 N 0 0 0 0 0 58.2333 64.5973 -0.6719 O 0 0 0 0 0 63.9092 64.0261 1.9177 C 0 0 0 0 0 64.6277 59.6015 1.3937 N 0 0 0 0 0 64.5571 63.3728 2.6805 O 0 0 0 0 0 66.9238 65.4300 0.2976 C 0 0 0 0 0 62.1841 62.9146 -2.2832 N 0 0 0 0 0 60.3314 64.2135 -2.7998 O 0 0 0 0 0 61.6664 63.8793 -3.0222 C 0 0 0 0 0 68.6862 63.8124 0.8741 N 0 0 0 0 0 62.2768 60.2238 1.2545 C 0 0 0 0 0 59.1114 62.1241 0.3406 O 0 0 0 0 0 68.7337 61.4617 -0.0084 C 0 0 0 0 0 60.6293 64.6433 0.0269 O 0 0 0 0 0 61.8480 63.4398 3.1435 C 0 0 0 0 0 65.9633 59.6084 0.7809 C 0 0 0 0 0 61.3752 62.3476 -1.4176 O 0 0 0 0 0 64.6656 64.6802 0.7775 C 0 0 0 0 0 68.4056 65.1204 0.3369 C 0 0 0 0 0 66.5888 66.4579 -0.1409 O 0 0 0 0 0 61.0693 59.3322 0.9768 C 0 0 0 0 0 60.3380 63.6682 3.0466 C 0 0 0 0 0 64.3323 64.3081 -0.6586 C 0 0 0 0 0 59.7987 59.9722 1.4192 C 0 0 0 0 0 59.8020 65.0985 3.1304 C 0 0 0 0 0 64.3037 62.8272 -0.9645 C 0 0 0 0 0 58.5498 59.7780 0.6198 C 0 0 0 0 0 60.3592 65.9237 2.0020 C 0 0 0 0 0 63.5676 62.4991 -2.2627 C 0 0 0 0 0 57.6557 66.6258 0.7557 C 0 0 0 0 0 57.2136 60.0065 -1.8199 C 0 0 0 0 0 62.4214 64.5871 -4.0895 C 0 0 0 0 0 59.7145 63.3689 -1.1142 FE 0 0 0 0 0 62.7046 62.2259 1.1483 H 0 0 0 0 0 68.5434 60.4599 1.9004 H 0 0 0 0 0 62.0764 64.6678 1.4682 H 0 0 0 0 0 66.4408 63.7927 1.3127 H 0 0 0 0 0 64.5244 59.4390 2.3749 H 0 0 0 0 0 68.8964 63.6183 1.8324 H 0 0 0 0 0 62.4944 59.7427 2.2191 H 0 0 0 0 0 68.3060 61.0471 -0.9330 H 0 0 0 0 0 69.7994 61.1963 0.0534 H 0 0 0 0 0 62.1964 63.7708 4.1328 H 0 0 0 0 0 65.8527 59.5193 -0.3100 H 0 0 0 0 0 66.5334 58.7481 1.1628 H 0 0 0 0 0 64.4295 65.7517 0.8557 H 0 0 0 0 0 68.9058 65.8729 0.9643 H 0 0 0 0 0 68.8031 65.1730 -0.6876 H 0 0 0 0 0 61.0124 59.1360 -0.1037 H 0 0 0 0 0 61.1961 58.3821 1.5156 H 0 0 0 0 0 60.0105 63.2559 2.0807 H 0 0 0 0 0 59.8715 63.0999 3.8652 H 0 0 0 0 0 63.3391 64.7207 -0.8928 H 0 0 0 0 0 65.0860 64.7733 -1.3110 H 0 0 0 0 0 59.5898 59.5979 2.4323 H 0 0 0 0 0 59.9854 61.0554 1.4602 H 0 0 0 0 0 60.1024 65.5439 4.0908 H 0 0 0 0 0 58.7048 65.0805 3.0618 H 0 0 0 0 0 65.3395 62.4664 -1.0479 H 0 0 0 0 0 63.8008 62.3083 -0.1353 H 0 0 0 0 0 58.6237 58.9058 -0.0461 H 0 0 0 0 0 57.6653 59.6718 1.2652 H 0 0 0 0 0 60.0587 66.9745 2.1271 H 0 0 0 0 0 61.4569 65.8544 1.9979 H 0 0 0 0 0 64.0906 62.9995 -3.0911 H 0 0 0 0 0 63.6019 61.4101 -2.4131 H 0 0 0 0 0 56.7008 66.5199 0.2208 H 0 0 0 0 0 57.4825 66.5285 1.8379 H 0 0 0 0 0 58.0886 67.6144 0.5405 H 0 0 0 0 0 56.9538 60.1695 -2.8764 H 0 0 0 0 0 57.7210 59.0357 -1.7130 H 0 0 0 0 0 56.2969 60.0105 -1.2121 H 0 0 0 0 0 61.7647 65.3218 -4.5787 H 0 0 0 0 0 63.2848 65.1054 -3.6454 H 0 0 0 0 0 62.7741 63.8579 -4.8340 H 0 0 0 0 0 26 35 1 0 0 0 26 4 1 0 0 0 35 22 1 0 0 0 4 29 1 0 0 0 4 6 2 0 0 0 29 5 1 0 0 0 5 13 1 0 0 0 22 36 2 0 0 0 22 11 1 0 0 0 13 15 2 0 0 0 13 32 1 0 0 0 11 34 1 0 0 0 32 20 1 0 0 0 34 39 1 0 0 0 34 19 1 0 0 0 21 19 2 0 0 0 39 42 1 0 0 0 19 8 1 0 0 0 20 1 1 0 0 0 42 45 1 0 0 0 45 23 1 0 0 0 1 3 2 0 0 0 1 27 1 0 0 0 8 31 1 0 0 0 2 10 1 0 0 0 2 27 1 0 0 0 48 25 1 0 0 0 31 10 1 0 0 0 31 38 1 0 0 0 10 12 2 0 0 0 27 37 1 0 0 0 23 25 1 0 0 0 23 33 1 0 0 0 25 24 2 0 0 0 33 49 1 0 0 0 44 41 1 0 0 0 44 17 1 0 0 0 30 17 1 0 0 0 30 49 1 0 0 0 38 41 1 0 0 0 37 40 1 0 0 0 17 16 1 0 0 0 24 49 1 0 0 0 49 28 1 0 0 0 49 18 1 0 0 0 49 9 1 0 0 0 40 43 1 0 0 0 16 18 2 0 0 0 16 46 1 0 0 0 28 14 1 0 0 0 9 7 2 0 0 0 14 43 1 0 0 0 14 7 1 0 0 0 7 47 1 0 0 0 2 50 1 0 0 0 5 51 1 0 0 0 8 52 1 0 0 0 11 53 1 0 0 0 20 54 1 0 0 0 26 55 1 0 0 0 27 56 1 0 0 0 29 57 1 0 0 0 29 58 1 0 0 0 31 59 1 0 0 0 32 60 1 0 0 0 32 61 1 0 0 0 34 62 1 0 0 0 35 63 1 0 0 0 35 64 1 0 0 0 37 65 1 0 0 0 37 66 1 0 0 0 38 67 1 0 0 0 38 68 1 0 0 0 39 69 1 0 0 0 39 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 43 77 1 0 0 0 43 78 1 0 0 0 44 79 1 0 0 0 44 80 1 0 0 0 45 81 1 0 0 0 45 82 1 0 0 0 46 83 1 0 0 0 46 84 1 0 0 0 46 85 1 0 0 0 47 86 1 0 0 0 47 87 1 0 0 0 47 88 1 0 0 0 48 89 1 0 0 0 48 90 1 0 0 0 48 91 1 0 0 0 M END $$$$