MDL Converted by convert_cif2sdf.py 2024/03/29 11:09:15 69 72 0 0 0 0 0 0 0 0999 V2000 2.4987 -0.1837 1.9993 N 0 0 0 0 0 2.3323 0.2961 0.6213 C 0 0 0 0 0 0.8850 0.6379 0.3793 C 0 0 0 0 0 0.1776 0.9715 1.3052 O 0 0 0 0 0 3.1934 1.5430 0.4079 C 0 0 0 0 0 4.6491 1.1741 0.5287 C 0 0 0 0 0 5.3572 0.7763 -0.5899 C 0 0 0 0 0 5.2788 1.2397 1.7577 C 0 0 0 0 0 6.6928 0.4387 -0.4788 C 0 0 0 0 0 6.6133 0.8969 1.8696 C 0 0 0 0 0 7.3214 0.4991 0.7510 C 0 0 0 0 0 2.2178 -1.6227 2.0940 C 0 0 0 0 0 0.3761 0.5726 -0.8677 N 0 0 0 0 0 -1.0134 0.8719 -1.2431 C 0 0 0 0 0 -1.9492 -0.0785 -0.5421 C 0 0 0 0 0 -1.5067 -0.9287 0.2016 O 0 0 0 0 0 -1.1243 0.6909 -2.7713 C 0 0 0 0 0 0.3447 0.8410 -3.2489 C 0 0 0 0 0 1.1199 0.1838 -2.0794 C 0 0 0 0 0 -3.2791 0.0148 -0.7418 N 0 0 0 0 0 -4.1891 -0.9090 -0.0610 C 0 0 0 0 0 -5.5698 -0.2620 0.0704 C 0 0 0 0 0 -5.4763 0.9418 0.9710 C 0 0 0 0 0 -5.7289 0.9748 2.2896 C 0 0 0 0 0 -5.0863 2.2981 0.5759 C 0 0 0 0 0 -5.1447 3.0756 1.7475 C 0 0 0 0 0 -5.5387 2.2418 2.7695 N 0 0 0 0 0 -4.8233 4.4280 1.6841 C 0 0 0 0 0 -4.4529 4.9867 0.4805 C 0 0 0 0 0 -4.3966 4.2152 -0.6718 C 0 0 0 0 0 -4.7088 2.8857 -0.6326 C 0 0 0 0 0 -4.3049 -2.1817 -0.8610 C 0 0 0 0 0 -3.9217 -2.2112 -2.0055 O 0 0 0 0 0 -4.8984 -3.4152 -0.2321 C 0 0 0 0 0 -6.2449 -3.1854 0.0660 F 0 0 0 0 0 -4.7943 -4.4886 -1.1234 F 0 0 0 0 0 -4.1398 -3.7469 1.0553 C 0 0 0 0 0 -4.2440 -2.6735 1.9466 F 0 0 0 0 0 -4.6907 -4.8930 1.6392 F 0 0 0 0 0 -2.7931 -3.9777 0.7571 F 0 0 0 0 0 1.9178 0.3409 2.6373 H 0 0 0 0 0 2.6427 -0.4832 -0.0752 H 0 0 0 0 0 3.0028 1.9502 -0.5854 H 0 0 0 0 0 2.9436 2.2900 1.1607 H 0 0 0 0 0 4.8670 0.7291 -1.5511 H 0 0 0 0 0 4.7267 1.5546 2.6315 H 0 0 0 0 0 7.2464 0.1271 -1.3525 H 0 0 0 0 0 7.1045 0.9443 2.8308 H 0 0 0 0 0 8.3643 0.2336 0.8385 H 0 0 0 0 0 2.4292 -1.9682 3.1056 H 0 0 0 0 0 1.1678 -1.8035 1.8602 H 0 0 0 0 0 2.8459 -2.1626 1.3859 H 0 0 0 0 0 -1.2561 1.8997 -0.9748 H 0 0 0 0 0 -1.7530 1.4659 -3.2090 H 0 0 0 0 0 -1.5089 -0.3006 -3.0116 H 0 0 0 0 0 0.6149 1.8907 -3.3557 H 0 0 0 0 0 0.5096 0.2999 -4.1801 H 0 0 0 0 0 2.1397 0.5662 -2.0386 H 0 0 0 0 0 1.1252 -0.9008 -2.1896 H 0 0 0 0 0 -3.6338 0.6944 -1.3368 H 0 0 0 0 0 -3.7990 -1.1384 0.9314 H 0 0 0 0 0 -5.9209 0.0470 -0.9142 H 0 0 0 0 0 -6.2692 -0.9815 0.4961 H 0 0 0 0 0 -6.0371 0.1264 2.8829 H 0 0 0 0 0 -5.6597 2.5116 3.6938 H 0 0 0 0 0 -4.8641 5.0370 2.5748 H 0 0 0 0 0 -4.2040 6.0374 0.4341 H 0 0 0 0 0 -4.1039 4.6694 -1.6065 H 0 0 0 0 0 -4.6624 2.2913 -1.5328 H 0 0 0 0 0 12 1 1 0 0 0 12 50 1 0 0 0 12 51 1 0 0 0 12 52 1 0 0 0 1 2 1 0 0 0 1 41 1 0 0 0 2 3 1 0 0 0 2 5 1 0 0 0 2 42 1 0 0 0 3 13 1 0 0 0 3 4 2 0 0 0 13 19 1 0 0 0 13 14 1 0 0 0 19 18 1 0 0 0 19 58 1 0 0 0 19 59 1 0 0 0 18 17 1 0 0 0 18 56 1 0 0 0 18 57 1 0 0 0 17 14 1 0 0 0 17 54 1 0 0 0 17 55 1 0 0 0 14 15 1 0 0 0 14 53 1 0 0 0 15 20 1 0 0 0 15 16 2 0 0 0 20 21 1 0 0 0 20 60 1 0 0 0 21 22 1 0 0 0 21 32 1 0 0 0 21 61 1 0 0 0 22 23 1 0 0 0 22 62 1 0 0 0 22 63 1 0 0 0 23 24 2 0 0 0 23 25 1 0 0 0 24 27 1 0 0 0 24 64 1 0 0 0 25 26 2 0 0 0 25 31 1 0 0 0 26 27 1 0 0 0 26 28 1 0 0 0 27 65 1 0 0 0 28 29 2 0 0 0 28 66 1 0 0 0 29 30 1 0 0 0 29 67 1 0 0 0 30 31 2 0 0 0 30 68 1 0 0 0 31 69 1 0 0 0 32 33 2 0 0 0 32 34 1 0 0 0 34 35 1 0 0 0 34 36 1 0 0 0 34 37 1 0 0 0 37 38 1 0 0 0 37 39 1 0 0 0 37 40 1 0 0 0 5 6 1 0 0 0 5 43 1 0 0 0 5 44 1 0 0 0 6 7 2 0 0 0 6 8 1 0 0 0 7 9 1 0 0 0 7 45 1 0 0 0 9 11 2 0 0 0 9 47 1 0 0 0 11 10 1 0 0 0 11 49 1 0 0 0 10 8 2 0 0 0 10 48 1 0 0 0 8 46 1 0 0 0 M END $$$$