DAR Converted by convert_cif2sdf.py 2026/01/30 11:05:38 27 26 0 0 0 0 0 0 0 0999 V2000 4.7779 -2.3287 -0.0975 N 0 0 0 0 0 4.0055 -2.6165 1.1181 C 0 0 0 0 0 3.6510 -1.3032 1.8198 C 0 0 0 0 0 2.7142 -0.4862 0.9284 C 0 0 0 0 0 2.3598 0.8271 1.6301 C 0 0 0 0 0 1.4628 1.6100 0.7759 N 0 0 0 0 0 1.0094 2.8297 1.1981 C 0 0 0 0 0 1.3834 3.3050 2.3838 N 0 0 0 0 0 0.1937 3.5411 0.4216 N 0 3 0 0 0 4.8276 -3.4752 2.0446 C 0 0 0 0 0 4.2251 -4.1902 3.0077 O 0 0 0 0 0 6.0280 -3.5191 1.9211 O 0 0 0 0 0 5.6117 -1.8427 0.1972 H 0 0 0 0 0 5.0767 -3.2185 -0.4680 H 0 0 0 0 0 3.0897 -3.1435 0.8507 H 0 0 0 0 0 3.1555 -1.5195 2.7667 H 0 0 0 0 0 4.5615 -0.7343 2.0079 H 0 0 0 0 0 3.2098 -0.2699 -0.0186 H 0 0 0 0 0 1.8032 -1.0542 0.7401 H 0 0 0 0 0 1.8644 0.6108 2.5760 H 0 0 0 0 0 3.2704 1.3960 1.8172 H 0 0 0 0 0 1.1892 1.2632 -0.0875 H 0 0 0 0 0 1.9774 2.7876 2.9486 H 0 0 0 0 0 1.0619 4.1709 2.6822 H 0 0 0 0 0 -0.1282 4.4057 0.7210 H 0 0 0 0 0 -0.0789 3.1948 -0.4426 H 0 0 0 0 0 -37.4328 -2.6402 1.3816 H 0 0 0 0 0 1 2 1 0 0 0 1 13 1 0 0 0 1 14 1 0 0 0 2 3 1 0 0 0 2 10 1 0 0 0 2 15 1 0 0 0 3 4 1 0 0 0 3 16 1 0 0 0 3 17 1 0 0 0 4 5 1 0 0 0 4 18 1 0 0 0 4 19 1 0 0 0 5 6 1 0 0 0 5 20 1 0 0 0 5 21 1 0 0 0 6 7 1 0 0 0 6 22 1 0 0 0 7 8 1 0 0 0 7 9 2 0 0 0 8 23 1 0 0 0 8 24 1 0 0 0 9 25 1 0 0 0 9 26 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 12 27 1 0 0 0 M END $$$$