096 Converted by convert_cif2sdf.py 2026/01/30 11:05:38 61 64 0 0 0 0 0 0 0 0999 V2000 -2.1670 0.2869 3.1232 S 0 0 0 0 0 -4.9826 0.5937 -1.5997 C 0 0 0 0 0 -1.6838 -1.3955 1.2014 N 0 0 0 0 0 -4.1130 1.6841 -1.9104 O 0 0 0 0 0 -2.9645 1.7841 -1.1889 C 0 0 0 0 0 -2.3296 -2.6596 -2.1359 N 0 0 0 0 0 -2.7517 -3.2302 1.8554 O 0 0 0 0 0 -2.6797 0.8500 -0.2055 C 0 0 0 0 0 4.0487 0.4786 0.6593 N 0 0 0 0 0 -2.3439 3.7377 -2.4058 O 0 0 0 0 0 -1.5130 0.9528 0.5290 C 0 0 0 0 0 6.4454 -0.0228 -0.7916 N 0 0 0 0 0 -1.2050 -0.0640 1.5979 C 0 0 0 0 0 -2.5195 -1.4829 3.4688 C 0 0 0 0 0 -2.3315 -2.1194 2.1058 C 0 0 0 0 0 -1.4627 -1.8864 -0.0913 C 0 0 0 0 0 -0.1664 -2.0694 -0.5653 C 0 0 0 0 0 0.0008 -2.5571 -1.8510 C 0 0 0 0 0 -1.1145 -2.8439 -2.6149 C 0 0 0 0 0 -2.5339 -2.1966 -0.9190 C 0 0 0 0 0 -0.6280 1.9865 0.2851 C 0 0 0 0 0 0.6431 2.0941 1.0876 C 0 0 0 0 0 1.7222 1.2145 0.4537 C 0 0 0 0 0 3.0126 1.3234 1.2688 C 0 0 0 0 0 5.3621 0.7354 1.2675 C 0 0 0 0 0 6.3961 -0.2167 0.6633 C 0 0 0 0 0 7.4825 -0.8676 -1.4011 C 0 0 0 0 0 5.1329 -0.2796 -1.3998 C 0 0 0 0 0 4.0989 0.6735 -0.7961 C 0 0 0 0 0 -0.9058 2.9212 -0.6953 C 0 0 0 0 0 -2.0717 2.8211 -1.4379 C 0 0 0 0 0 -5.2973 0.6667 -0.5588 H 0 0 0 0 0 -5.8586 0.6320 -2.2472 H 0 0 0 0 0 -4.4562 -0.3473 -1.7551 H 0 0 0 0 0 -3.3694 0.0415 -0.0126 H 0 0 0 0 0 -2.8409 4.5058 -2.0910 H 0 0 0 0 0 -0.1366 -0.0859 1.8126 H 0 0 0 0 0 -1.8069 -1.8879 4.1872 H 0 0 0 0 0 -3.5420 -1.6134 3.8237 H 0 0 0 0 0 0.6875 -1.8367 0.0534 H 0 0 0 0 0 0.9920 -2.7111 -2.2515 H 0 0 0 0 0 -0.9899 -3.2240 -3.6182 H 0 0 0 0 0 -3.5428 -2.0585 -0.5618 H 0 0 0 0 0 0.9793 3.1304 1.0988 H 0 0 0 0 0 0.4566 1.7612 2.1090 H 0 0 0 0 0 1.3859 0.1770 0.4421 H 0 0 0 0 0 1.9086 1.5475 -0.5677 H 0 0 0 0 0 2.8262 0.9905 2.2902 H 0 0 0 0 0 3.3488 2.3605 1.2796 H 0 0 0 0 0 5.6580 1.7660 1.0712 H 0 0 0 0 0 5.3021 0.5732 2.3440 H 0 0 0 0 0 6.1138 -1.2469 0.8840 H 0 0 0 0 0 7.3763 -0.0087 1.0920 H 0 0 0 0 0 7.5438 -0.6547 -2.4686 H 0 0 0 0 0 8.4435 -0.6565 -0.9321 H 0 0 0 0 0 7.2289 -1.9170 -1.2529 H 0 0 0 0 0 5.1919 -0.1173 -2.4762 H 0 0 0 0 0 4.8371 -1.3101 -1.2034 H 0 0 0 0 0 3.1177 0.4646 -1.2243 H 0 0 0 0 0 4.3803 1.7027 -1.0162 H 0 0 0 0 0 -0.2130 3.7285 -0.8843 H 0 0 0 0 0 1 14 1 0 0 0 1 13 1 0 0 0 2 4 1 0 0 0 2 32 1 0 0 0 2 33 1 0 0 0 2 34 1 0 0 0 16 3 1 0 0 0 3 15 1 0 0 0 3 13 1 0 0 0 4 5 1 0 0 0 5 31 2 0 0 0 5 8 1 0 0 0 19 6 2 0 0 0 6 20 1 0 0 0 7 15 2 0 0 0 8 11 2 0 0 0 8 35 1 0 0 0 29 9 1 0 0 0 25 9 1 0 0 0 9 24 1 0 0 0 10 31 1 0 0 0 10 36 1 0 0 0 11 21 1 0 0 0 11 13 1 0 0 0 27 12 1 0 0 0 26 12 1 0 0 0 12 28 1 0 0 0 13 37 1 0 0 0 15 14 1 0 0 0 14 38 1 0 0 0 14 39 1 0 0 0 17 16 1 0 0 0 16 20 2 0 0 0 18 17 2 0 0 0 17 40 1 0 0 0 18 19 1 0 0 0 18 41 1 0 0 0 19 42 1 0 0 0 20 43 1 0 0 0 30 21 2 0 0 0 21 22 1 0 0 0 23 22 1 0 0 0 22 44 1 0 0 0 22 45 1 0 0 0 23 24 1 0 0 0 23 46 1 0 0 0 23 47 1 0 0 0 24 48 1 0 0 0 24 49 1 0 0 0 26 25 1 0 0 0 25 50 1 0 0 0 25 51 1 0 0 0 26 52 1 0 0 0 26 53 1 0 0 0 27 54 1 0 0 0 27 55 1 0 0 0 27 56 1 0 0 0 29 28 1 0 0 0 28 57 1 0 0 0 28 58 1 0 0 0 29 59 1 0 0 0 29 60 1 0 0 0 31 30 1 0 0 0 30 61 1 0 0 0 M END $$$$