CBR Converted by convert_cif2sdf.py 2024/03/29 11:09:15 34 35 0 0 0 0 0 0 0 0999 V2000 1.5143 -4.7320 1.1809 BR 0 0 0 0 0 -3.3921 -3.9639 1.9507 P 0 0 0 0 0 -3.5731 -4.9284 3.0862 O 0 0 0 0 0 -2.2973 -4.3994 0.8424 O 0 0 0 0 0 -2.9271 -2.4755 2.3853 O 0 0 0 0 0 1.0925 -0.6674 1.7565 N 0 0 0 0 0 0.8511 -2.0223 1.5915 C 0 0 0 0 0 2.4222 -0.1881 1.7296 C 0 0 0 0 0 2.6689 1.0104 1.8720 O 0 0 0 0 0 3.4517 -1.0911 1.5380 N 0 0 0 0 0 3.2176 -2.3697 1.3825 C 0 0 0 0 0 4.2844 -3.2209 1.1965 N 0 0 0 0 0 1.8248 -2.9147 1.4045 C 0 0 0 0 0 -0.5986 0.7339 0.6469 C 0 0 0 0 0 -2.7329 -1.5052 1.3700 C 0 0 0 0 0 -2.3023 -0.1954 2.0168 C 0 0 0 0 0 -1.0434 -0.4224 2.6800 O 0 0 0 0 0 0.0003 0.2407 1.9539 C 0 0 0 0 0 -2.0560 0.9135 1.0036 C 0 0 0 0 0 -2.2477 2.1852 1.6193 O 0 0 0 0 0 -4.7200 -3.6850 1.0724 O 0 0 0 0 0 -2.3318 -5.3080 0.4739 H 0 0 0 0 0 -0.1944 -2.3140 1.6239 H 0 0 0 0 0 4.1042 -4.1943 1.1728 H 0 0 0 0 0 5.1848 -2.8206 1.0948 H 0 0 0 0 0 -0.5002 -0.0292 -0.1346 H 0 0 0 0 0 -0.1090 1.6483 0.2975 H 0 0 0 0 0 -1.9625 -1.8601 0.6818 H 0 0 0 0 0 -3.6703 -1.3693 0.8250 H 0 0 0 0 0 -3.0347 0.0941 2.7768 H 0 0 0 0 0 0.3638 1.0719 2.5678 H 0 0 0 0 0 -2.7210 0.8672 0.1365 H 0 0 0 0 0 -2.8770 2.6824 1.0678 H 0 0 0 0 0 -5.2531 -4.4479 0.7623 H 0 0 0 0 0 1 13 1 0 0 0 2 3 2 0 0 0 2 4 1 0 0 0 2 5 1 0 0 0 2 21 1 0 0 0 4 22 1 0 0 0 5 15 1 0 0 0 6 7 1 0 0 0 6 8 1 0 0 0 6 18 1 0 0 0 7 13 2 0 0 0 7 23 1 0 0 0 8 9 2 0 0 0 8 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 11 13 1 0 0 0 12 24 1 0 0 0 12 25 1 0 0 0 14 18 1 0 0 0 14 19 1 0 0 0 14 26 1 0 0 0 14 27 1 0 0 0 15 16 1 0 0 0 15 28 1 0 0 0 15 29 1 0 0 0 16 17 1 0 0 0 16 19 1 0 0 0 16 30 1 0 0 0 17 18 1 0 0 0 18 31 1 0 0 0 19 20 1 0 0 0 19 32 1 0 0 0 20 33 1 0 0 0 21 34 1 0 0 0 M END $$$$