9GP Converted by convert_cif2sdf.py 2024/03/29 11:09:15 31 31 0 0 0 0 0 0 0 0999 V2000 -0.5253 2.6958 -0.3922 O 0 0 0 0 0 0.1757 1.5563 0.1097 C 0 0 0 0 0 1.6059 1.5508 -0.4403 C 0 0 0 0 0 2.3037 2.7046 0.0331 O 0 0 0 0 0 2.3213 0.2857 0.0426 C 0 0 0 0 0 3.6322 0.2334 -0.5232 O 0 0 0 0 0 1.5238 -0.9434 -0.4026 C 0 0 0 0 0 2.1996 -2.2099 0.1263 C 0 0 0 0 0 1.5236 -3.3603 -0.3838 O 0 0 0 0 0 0.1952 -0.8603 0.1174 O 0 0 0 0 0 -0.5394 0.2783 -0.3371 C 0 0 0 0 0 -1.8888 0.2491 0.2327 N 0 0 0 0 0 -2.9058 -0.2847 -0.4721 C 0 0 0 0 0 -2.7042 -0.7405 -1.5781 O 0 0 0 0 0 -4.2942 -0.3153 0.1137 C 0 0 0 0 0 -5.1909 -0.9242 -0.8173 O 0 0 0 0 0 -1.4407 2.7600 -0.0885 H 0 0 0 0 0 0.2031 1.5963 1.1987 H 0 0 0 0 0 1.5776 1.5611 -1.5295 H 0 0 0 0 0 1.9011 3.5434 -0.2294 H 0 0 0 0 0 2.3927 0.2989 1.1299 H 0 0 0 0 0 4.1933 0.9850 -0.2872 H 0 0 0 0 0 1.4868 -0.9783 -1.4909 H 0 0 0 0 0 3.2413 -2.2277 -0.1963 H 0 0 0 0 0 2.1570 -2.2163 1.2161 H 0 0 0 0 0 1.8994 -4.2010 -0.0887 H 0 0 0 0 0 -0.6031 0.2588 -1.4252 H 0 0 0 0 0 -2.0503 0.6135 1.1169 H 0 0 0 0 0 -4.2848 -0.8903 1.0395 H 0 0 0 0 0 -4.6234 0.7038 0.3215 H 0 0 0 0 0 -6.1052 -0.9778 -0.5059 H 0 0 0 0 0 1 2 1 0 0 0 1 17 1 0 0 0 3 2 1 0 0 0 2 11 1 0 0 0 2 18 1 0 0 0 4 3 1 0 0 0 3 5 1 0 0 0 3 19 1 0 0 0 4 20 1 0 0 0 6 5 1 0 0 0 5 7 1 0 0 0 5 21 1 0 0 0 6 22 1 0 0 0 7 8 1 0 0 0 7 10 1 0 0 0 7 23 1 0 0 0 9 8 1 0 0 0 8 24 1 0 0 0 8 25 1 0 0 0 9 26 1 0 0 0 11 10 1 0 0 0 11 12 1 0 0 0 11 27 1 0 0 0 12 13 1 0 0 0 12 28 1 0 0 0 13 14 2 0 0 0 13 15 1 0 0 0 16 15 1 0 0 0 15 29 1 0 0 0 15 30 1 0 0 0 16 31 1 0 0 0 M END $$$$