AKG Converted by convert_cif2sdf.py 2024/03/29 11:09:15 16 15 0 0 0 0 0 0 0 0999 V2000 -2.8338 -0.2049 -0.0033 C 0 0 0 0 0 -2.8898 -1.4167 -0.0025 O 0 0 0 0 0 -3.9669 0.5215 0.0016 O 0 0 0 0 0 -1.5096 0.4802 -0.0019 C 0 0 0 0 0 -1.4538 1.6869 -0.0027 O 0 0 0 0 0 -0.2408 -0.3327 -0.0017 C 0 0 0 0 0 0.9673 0.6062 -0.0003 C 0 0 0 0 0 2.2361 -0.2057 -0.0001 C 0 0 0 0 0 2.1803 -1.4134 0.0007 O 0 0 0 0 0 3.4285 0.4105 0.0013 O 0 0 0 0 0 -4.8010 0.0322 0.0053 H 0 0 0 0 0 -0.2129 -0.9615 0.8892 H 0 0 0 0 0 -0.2115 -0.9612 -0.8908 H 0 0 0 0 0 0.9384 1.2350 -0.8912 H 0 0 0 0 0 0.9380 1.2357 0.8898 H 0 0 0 0 0 4.2138 -0.1530 0.0014 H 0 0 0 0 0 1 2 2 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 3 11 1 0 0 0 4 5 2 0 0 0 4 6 1 0 0 0 6 7 1 0 0 0 6 12 1 0 0 0 6 13 1 0 0 0 7 8 1 0 0 0 7 14 1 0 0 0 7 15 1 0 0 0 8 9 2 0 0 0 8 10 1 0 0 0 10 16 1 0 0 0 M END $$$$