CBF Converted by convert_cif2sdf.py 2024/03/29 11:09:15 28 28 0 0 0 0 0 0 0 0999 V2000 -2.5698 2.2188 -0.5211 O 0 0 0 0 0 -2.3603 0.9697 0.1389 C 0 0 0 0 0 -1.1151 0.2913 -0.4360 C 0 0 0 0 0 0.0384 1.0771 -0.1317 O 0 0 0 0 0 1.2598 0.5449 -0.6478 C 0 0 0 0 0 1.1663 0.4277 -2.0692 O 0 0 0 0 0 2.3999 1.4655 -0.2933 C 0 0 0 0 0 3.0079 2.0428 -1.1694 O 0 0 0 0 0 2.7431 1.6465 0.9977 N 0 0 0 0 0 1.5112 -0.8369 -0.0375 C 0 0 0 0 0 2.7013 -1.3966 -0.5950 O 0 0 0 0 0 0.3211 -1.7485 -0.3512 C 0 0 0 0 0 0.5127 -3.0180 0.2763 O 0 0 0 0 0 -0.9599 -1.0997 0.1838 C 0 0 0 0 0 -2.0856 -1.9068 -0.1673 O 0 0 0 0 0 -3.3447 2.7051 -0.2065 H 0 0 0 0 0 -2.2205 1.1414 1.2065 H 0 0 0 0 0 -3.2278 0.3267 -0.0150 H 0 0 0 0 0 -1.2177 0.1995 -1.5164 H 0 0 0 0 0 1.0070 1.2665 -2.5228 H 0 0 0 0 0 2.2562 1.1849 1.6980 H 0 0 0 0 0 3.4765 2.2394 1.2258 H 0 0 0 0 0 1.6235 -0.7427 1.0422 H 0 0 0 0 0 3.4959 -0.8671 -0.4387 H 0 0 0 0 0 0.2395 -1.8834 -1.4299 H 0 0 0 0 0 1.3109 -3.4818 -0.0103 H 0 0 0 0 0 -0.8983 -1.0119 1.2676 H 0 0 0 0 0 -2.9336 -1.5536 0.1364 H 0 0 0 0 0 1 2 1 0 0 0 1 16 1 0 0 0 2 3 1 0 0 0 2 17 1 0 0 0 2 18 1 0 0 0 3 4 1 0 0 0 3 14 1 0 0 0 3 19 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 5 7 1 0 0 0 5 10 1 0 0 0 6 20 1 0 0 0 7 8 2 0 0 0 7 9 1 0 0 0 9 21 1 0 0 0 9 22 1 0 0 0 10 11 1 0 0 0 10 12 1 0 0 0 10 23 1 0 0 0 11 24 1 0 0 0 12 13 1 0 0 0 12 14 1 0 0 0 12 25 1 0 0 0 13 26 1 0 0 0 14 15 1 0 0 0 14 27 1 0 0 0 15 28 1 0 0 0 M END $$$$