9CB Converted by convert_cif2sdf.py 2024/03/29 11:09:15 39 41 0 0 0 0 0 0 0 0999 V2000 -4.5124 0.7786 -1.3880 O 0 0 0 0 0 -3.5544 1.5882 -0.7049 C 0 0 0 0 0 -3.2262 0.9582 0.6498 C 0 0 0 0 0 -2.5647 -0.3326 0.4408 N 0 0 0 0 0 -3.3626 -1.5567 0.3398 C 0 0 0 0 0 -1.1772 -0.3945 0.3385 C 0 0 0 0 0 -0.4205 0.7682 0.4403 C 0 0 0 0 0 0.9516 0.7097 0.3400 C 0 0 0 0 0 -0.5501 -1.6217 0.1393 C 0 0 0 0 0 0.8206 -1.6864 0.0388 C 0 0 0 0 0 1.5829 -0.5199 0.1348 C 0 0 0 0 0 3.0533 -0.5856 0.0268 C 0 0 0 0 0 3.7376 0.5259 0.1266 N 0 0 0 0 0 5.0824 0.5398 0.0365 C 0 0 0 0 0 5.8094 1.7286 0.1439 C 0 0 0 0 0 7.1835 1.7003 0.0476 C 0 0 0 0 0 8.0840 3.1778 0.1811 CL 0 0 0 0 0 7.8581 0.5011 -0.1554 C 0 0 0 0 0 7.1629 -0.6835 -0.2656 C 0 0 0 0 0 5.7728 -0.6769 -0.1700 C 0 0 0 0 0 4.9841 -1.9119 -0.2793 C 0 0 0 0 0 5.5211 -2.9907 -0.4573 O 0 0 0 0 0 3.6395 -1.8068 -0.1684 N 0 0 0 0 0 -4.7672 1.1182 -2.2562 H 0 0 0 0 0 -2.6447 1.6576 -1.3020 H 0 0 0 0 0 -3.9648 2.5867 -0.5507 H 0 0 0 0 0 -2.5641 1.6191 1.2085 H 0 0 0 0 0 -4.1477 0.8063 1.2132 H 0 0 0 0 0 -3.6299 -1.7316 -0.7027 H 0 0 0 0 0 -2.7819 -2.4010 0.7117 H 0 0 0 0 0 -4.2695 -1.4498 0.9345 H 0 0 0 0 0 -0.9097 1.7186 0.5985 H 0 0 0 0 0 1.5378 1.6132 0.4187 H 0 0 0 0 0 -1.1407 -2.5228 0.0657 H 0 0 0 0 0 1.3069 -2.6392 -0.1155 H 0 0 0 0 0 5.2954 2.6655 0.3026 H 0 0 0 0 0 8.9351 0.4993 -0.2296 H 0 0 0 0 0 7.6930 -1.6109 -0.4229 H 0 0 0 0 0 3.0867 -2.6019 -0.2315 H 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 5 4 1 0 0 0 4 6 1 0 0 0 6 9 2 0 0 0 6 7 1 0 0 0 9 10 1 0 0 0 7 8 2 0 0 0 10 11 2 0 0 0 8 11 1 0 0 0 11 12 1 0 0 0 12 13 2 0 0 0 12 23 1 0 0 0 13 14 1 0 0 0 23 21 1 0 0 0 14 15 2 0 0 0 14 20 1 0 0 0 15 16 1 0 0 0 21 20 1 0 0 0 21 22 2 0 0 0 20 19 2 0 0 0 16 17 1 0 0 0 16 18 2 0 0 0 19 18 1 0 0 0 1 24 1 0 0 0 2 25 1 0 0 0 2 26 1 0 0 0 3 27 1 0 0 0 3 28 1 0 0 0 5 29 1 0 0 0 5 30 1 0 0 0 5 31 1 0 0 0 7 32 1 0 0 0 8 33 1 0 0 0 9 34 1 0 0 0 10 35 1 0 0 0 15 36 1 0 0 0 18 37 1 0 0 0 19 38 1 0 0 0 23 39 1 0 0 0 M END $$$$