F1B Converted by convert_cif2sdf.py 2024/03/29 11:09:15 53 56 0 0 0 0 0 0 0 0999 V2000 -0.7058 -3.3191 -0.2248 C 0 0 0 0 0 -2.8409 -2.6131 -0.1865 C 0 0 0 0 0 -2.6574 -0.2118 0.0751 C 0 0 0 0 0 0.3709 0.3497 0.0213 C 0 0 0 0 0 0.7810 1.0963 1.1293 C 0 0 0 0 0 2.9200 -0.8773 0.2880 C 0 0 0 0 0 -4.7012 1.1954 0.1989 C 0 0 0 0 0 4.0565 -1.7143 0.8803 C 0 0 0 0 0 3.3434 -0.3560 -1.0883 C 0 0 0 0 0 -6.2018 1.2860 0.3089 C 0 0 0 0 0 0.1402 3.1093 0.0015 C 0 0 0 0 0 4.6291 0.4606 -0.9438 C 0 0 0 0 0 6.9724 0.3259 -0.3506 C 0 0 0 0 0 -4.0298 2.2057 0.2179 O 0 0 0 0 0 -4.0528 -0.1159 0.0664 C 0 0 0 0 0 -4.8293 -1.2740 -0.0749 C 0 0 0 0 0 -4.2292 -2.5051 -0.2009 C 0 0 0 0 0 -1.9914 -3.7007 -0.2923 N 0 0 0 0 0 0.2578 -4.0627 -0.2889 O 0 0 0 0 0 -2.0574 -1.4538 -0.0512 C 0 0 0 0 0 -0.6502 -1.9092 -0.0705 C 0 0 0 0 0 0.4880 -1.1212 0.0332 C 0 0 0 0 0 0.6630 2.4693 1.1117 C 0 0 0 0 0 -0.2627 2.3765 -1.1012 C 0 0 0 0 0 -0.1559 1.0019 -1.0966 C 0 0 0 0 0 1.7212 -1.7089 0.1485 N 0 0 0 0 0 5.3222 -0.8579 0.9670 C 0 0 0 0 0 5.6864 -0.3841 -0.3741 N 0 0 0 0 0 -2.0514 0.6767 0.1782 H 0 0 0 0 0 1.1892 0.5980 1.9962 H 0 0 0 0 0 2.7046 -0.0362 0.9468 H 0 0 0 0 0 3.7780 -2.0534 1.8784 H 0 0 0 0 0 4.2439 -2.5778 0.2421 H 0 0 0 0 0 3.5197 -1.1975 -1.7578 H 0 0 0 0 0 2.5545 0.2750 -1.4966 H 0 0 0 0 0 -6.6358 0.2936 0.1827 H 0 0 0 0 0 -6.4705 1.6775 1.2899 H 0 0 0 0 0 -6.5840 1.9506 -0.4655 H 0 0 0 0 0 0.0539 4.1857 -0.0074 H 0 0 0 0 0 4.9420 0.8220 -1.9245 H 0 0 0 0 0 4.4488 1.3105 -0.2850 H 0 0 0 0 0 6.8791 1.2264 0.2570 H 0 0 0 0 0 7.7373 -0.3224 0.0765 H 0 0 0 0 0 7.2544 0.6014 -1.3664 H 0 0 0 0 0 -5.9068 -1.1999 -0.0814 H 0 0 0 0 0 -4.8372 -3.3903 -0.3130 H 0 0 0 0 0 -2.2867 -4.6187 -0.4014 H 0 0 0 0 0 0.9799 3.0485 1.9677 H 0 0 0 0 0 -0.6609 2.8837 -1.9679 H 0 0 0 0 0 -0.4787 0.4308 -1.9554 H 0 0 0 0 0 5.1378 -0.0028 1.6170 H 0 0 0 0 0 6.1373 -1.4551 1.3751 H 0 0 0 0 0 1.8002 -2.6756 0.1375 H 0 0 0 0 0 13 28 1 0 0 0 12 28 1 0 0 0 12 9 1 0 0 0 28 27 1 0 0 0 23 11 2 0 0 0 23 5 1 0 0 0 11 24 1 0 0 0 9 6 1 0 0 0 27 8 1 0 0 0 5 4 2 0 0 0 6 8 1 0 0 0 6 26 1 0 0 0 24 25 2 0 0 0 4 25 1 0 0 0 4 22 1 0 0 0 26 22 1 0 0 0 22 21 2 0 0 0 10 7 1 0 0 0 21 20 1 0 0 0 21 1 1 0 0 0 3 20 2 0 0 0 3 15 1 0 0 0 20 2 1 0 0 0 19 1 2 0 0 0 7 15 1 0 0 0 7 14 2 0 0 0 1 18 1 0 0 0 15 16 2 0 0 0 2 18 1 0 0 0 2 17 2 0 0 0 16 17 1 0 0 0 3 29 1 0 0 0 5 30 1 0 0 0 6 31 1 0 0 0 8 32 1 0 0 0 8 33 1 0 0 0 9 34 1 0 0 0 9 35 1 0 0 0 10 36 1 0 0 0 10 37 1 0 0 0 10 38 1 0 0 0 11 39 1 0 0 0 12 40 1 0 0 0 12 41 1 0 0 0 13 42 1 0 0 0 13 43 1 0 0 0 13 44 1 0 0 0 16 45 1 0 0 0 17 46 1 0 0 0 18 47 1 0 0 0 23 48 1 0 0 0 24 49 1 0 0 0 25 50 1 0 0 0 27 51 1 0 0 0 27 52 1 0 0 0 26 53 1 0 0 0 M END $$$$