9H2 Converted by convert_cif2sdf.py 2024/03/29 11:09:15 25 26 0 0 0 0 0 0 0 0999 V2000 -2.1868 -0.5558 -0.0120 C 0 0 0 0 0 -1.5047 -1.7225 0.2769 C 0 0 0 0 0 -0.1228 -1.7319 0.2919 C 0 0 0 0 0 0.5841 -0.5684 0.0146 C 0 0 0 0 0 -0.0999 0.6029 -0.2764 C 0 0 0 0 0 -1.4869 0.6087 -0.2896 C 0 0 0 0 0 1.9860 -0.5781 0.0298 N 0 0 0 0 0 2.7770 0.1057 0.9084 C 0 0 0 0 0 4.0649 -0.1547 0.6054 C 0 0 0 0 0 4.0717 -1.0297 -0.4996 C 0 0 0 0 0 2.7868 -1.2771 -0.8277 C 0 0 0 0 0 0.9610 2.3606 -0.6938 I 0 0 0 0 0 0.9071 -3.5026 0.7317 I 0 0 0 0 0 -3.6936 -0.5516 -0.0329 C 0 0 0 0 0 -4.1790 -1.8586 0.2817 O 0 0 0 0 0 -2.1591 1.7548 -0.5737 O 0 0 0 0 0 -2.0519 -2.6289 0.4924 H 0 0 0 0 0 2.4313 0.7444 1.7076 H 0 0 0 0 0 4.9332 0.2359 1.1156 H 0 0 0 0 0 4.9453 -1.4326 -0.9913 H 0 0 0 0 0 2.4495 -1.9151 -1.6313 H 0 0 0 0 0 -4.0651 0.1611 0.7036 H 0 0 0 0 0 -4.0429 -0.2638 -1.0240 H 0 0 0 0 0 -5.1427 -1.9296 0.2877 H 0 0 0 0 0 -2.3614 2.2951 0.2013 H 0 0 0 0 0 15 14 1 0 0 0 13 3 1 0 0 0 2 3 2 0 0 0 2 1 1 0 0 0 14 1 1 0 0 0 3 4 1 0 0 0 1 6 2 0 0 0 4 7 1 0 0 0 4 5 2 0 0 0 6 5 1 0 0 0 6 16 1 0 0 0 7 11 1 0 0 0 7 8 1 0 0 0 5 12 1 0 0 0 11 10 2 0 0 0 8 9 2 0 0 0 10 9 1 0 0 0 2 17 1 0 0 0 8 18 1 0 0 0 9 19 1 0 0 0 10 20 1 0 0 0 11 21 1 0 0 0 14 22 1 0 0 0 14 23 1 0 0 0 15 24 1 0 0 0 16 25 1 0 0 0 M END $$$$