CQK Converted by convert_cif2sdf.py 2024/03/29 11:09:15 21 22 0 0 0 0 0 0 0 0999 V2000 -2.3564 0.6248 -0.0011 C 0 0 0 0 0 1.3990 0.2724 -0.0005 C 0 0 0 0 0 0.1387 0.8625 -0.0014 C 0 0 0 0 0 0.4843 -1.8491 0.0009 C 0 0 0 0 0 -0.9911 0.0411 -0.0012 C 0 0 0 0 0 -0.8037 -1.3431 0.0000 C 0 0 0 0 0 2.6087 1.1281 -0.0008 C 0 0 0 0 0 -4.4542 0.8237 -0.0018 N 0 0 0 0 0 -3.9578 2.0116 0.0069 N 0 0 0 0 0 -3.4958 -0.0386 -0.0008 N 0 0 0 0 0 -2.6704 1.9276 0.0038 N 0 0 0 0 0 1.5282 -1.0491 0.0067 N 0 0 0 0 0 3.8329 0.5639 0.0001 N 0 0 0 0 0 4.9887 1.3814 -0.0001 O 0 0 0 0 0 2.4970 2.3377 -0.0019 O 0 0 0 0 0 0.0355 1.9371 -0.0016 H 0 0 0 0 0 0.6344 -2.9186 0.0021 H 0 0 0 0 0 -1.6531 -2.0094 -0.0038 H 0 0 0 0 0 -5.4003 0.6110 -0.0007 H 0 0 0 0 0 3.9217 -0.4018 0.0013 H 0 0 0 0 0 5.8197 0.8866 0.0008 H 0 0 0 0 0 4 6 2 0 0 0 4 12 1 0 0 0 6 5 1 0 0 0 12 2 2 0 0 0 5 1 1 0 0 0 5 3 2 0 0 0 11 1 1 0 0 0 11 9 2 0 0 0 1 10 2 0 0 0 9 8 1 0 0 0 2 3 1 0 0 0 2 7 1 0 0 0 10 8 1 0 0 0 7 13 1 0 0 0 7 15 2 0 0 0 13 14 1 0 0 0 3 16 1 0 0 0 4 17 1 0 0 0 6 18 1 0 0 0 8 19 1 0 0 0 13 20 1 0 0 0 14 21 1 0 0 0 M END $$$$