CXU Converted by convert_cif2sdf.py 2024/03/29 11:09:15 49 51 0 0 0 0 0 0 0 0999 V2000 -5.3953 1.3034 1.8472 CL 0 0 0 0 0 1.7357 -2.2701 -1.5834 C 0 0 0 0 0 1.2258 -3.2581 -1.1127 O 0 0 0 0 0 1.1812 -0.9074 -1.2563 C 0 0 0 0 0 0.0306 -1.0505 -0.3618 N 0 0 0 0 0 2.2607 -0.0685 -0.5697 C 0 0 0 0 0 2.9282 -0.9333 0.9134 S 0 0 0 0 0 4.5762 -0.1242 0.8355 C 0 0 0 0 0 4.6485 0.4091 -0.6076 C 0 0 0 0 0 3.4838 0.0293 -1.4148 N 0 0 0 0 0 4.7405 1.9127 -0.5668 C 0 0 0 0 0 -1.1950 -1.2836 -0.8720 C 0 0 0 0 0 -1.3454 -1.3767 -2.0748 O 0 0 0 0 0 -2.3522 -1.4279 0.0282 C 0 0 0 0 0 -2.8470 -2.5672 0.6101 C 0 0 0 0 0 -3.9016 -2.1957 1.3394 O 0 0 0 0 0 -4.1236 -1.0101 1.2903 N 0 0 0 0 0 -3.2637 -0.3795 0.5320 C 0 0 0 0 0 -2.3068 -3.9655 0.4556 C 0 0 0 0 0 -3.2156 1.0736 0.2397 C 0 0 0 0 0 -4.1596 1.9326 0.8023 C 0 0 0 0 0 -4.1100 3.2848 0.5263 C 0 0 0 0 0 -3.1268 3.7868 -0.3068 C 0 0 0 0 0 -2.1885 2.9398 -0.8672 C 0 0 0 0 0 -2.2243 1.5875 -0.5936 C 0 0 0 0 0 5.6891 -1.1424 1.0903 C 0 0 0 0 0 4.6581 1.0279 1.8402 C 0 0 0 0 0 5.9180 2.5065 -0.3170 O 0 0 0 0 0 3.7545 2.5839 -0.7601 O 0 0 0 0 0 2.5925 -2.3620 -2.2350 H 0 0 0 0 0 0.8674 -0.4122 -2.1763 H 0 0 0 0 0 0.1498 -0.9761 0.5977 H 0 0 0 0 0 1.8810 0.9193 -0.3105 H 0 0 0 0 0 5.5470 0.0173 -1.0829 H 0 0 0 0 0 3.6519 -0.8349 -1.9079 H 0 0 0 0 0 -1.5627 -4.1549 1.2297 H 0 0 0 0 0 -3.1214 -4.6831 0.5521 H 0 0 0 0 0 -1.8438 -4.0701 -0.5257 H 0 0 0 0 0 -4.8400 3.9513 0.9603 H 0 0 0 0 0 -3.0914 4.8451 -0.5216 H 0 0 0 0 0 -1.4232 3.3376 -1.5178 H 0 0 0 0 0 -1.4906 0.9271 -1.0317 H 0 0 0 0 0 5.6285 -1.9392 0.3493 H 0 0 0 0 0 6.6572 -0.6481 1.0154 H 0 0 0 0 0 5.5730 -1.5649 2.0881 H 0 0 0 0 0 4.5254 0.6401 2.8503 H 0 0 0 0 0 5.6318 1.5103 1.7612 H 0 0 0 0 0 3.8745 1.7544 1.6245 H 0 0 0 0 0 5.9281 3.4727 -0.3004 H 0 0 0 0 0 21 1 1 0 0 0 3 2 2 0 0 0 2 4 1 0 0 0 2 30 1 0 0 0 6 4 1 0 0 0 4 5 1 0 0 0 4 31 1 0 0 0 5 12 1 0 0 0 5 32 1 0 0 0 10 6 1 0 0 0 7 6 1 0 0 0 6 33 1 0 0 0 8 7 1 0 0 0 27 8 1 0 0 0 26 8 1 0 0 0 8 9 1 0 0 0 11 9 1 0 0 0 9 10 1 0 0 0 9 34 1 0 0 0 10 35 1 0 0 0 29 11 2 0 0 0 28 11 1 0 0 0 12 14 1 0 0 0 12 13 2 0 0 0 18 14 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 15 19 1 0 0 0 17 16 1 0 0 0 18 17 2 0 0 0 20 18 1 0 0 0 19 36 1 0 0 0 19 37 1 0 0 0 19 38 1 0 0 0 25 20 2 0 0 0 21 20 1 0 0 0 22 21 2 0 0 0 23 22 1 0 0 0 22 39 1 0 0 0 23 24 2 0 0 0 23 40 1 0 0 0 24 25 1 0 0 0 24 41 1 0 0 0 25 42 1 0 0 0 26 43 1 0 0 0 26 44 1 0 0 0 26 45 1 0 0 0 27 46 1 0 0 0 27 47 1 0 0 0 27 48 1 0 0 0 28 49 1 0 0 0 M END $$$$