0ND Converted by convert_cif2sdf.py 2024/03/29 11:09:15 29 30 0 0 0 0 0 0 0 0999 V2000 3.9208 -0.9413 -0.4376 B 0 0 0 0 0 3.3921 -2.2539 -0.3127 O 0 0 0 0 0 5.3245 -0.7466 -0.5169 O 0 0 0 0 0 2.9516 0.2920 -0.4957 C 0 0 0 0 0 2.8007 0.8578 0.8477 N 0 0 0 0 0 1.7351 2.0975 1.1094 S 0 0 0 0 0 1.7710 2.3713 2.5036 O 0 0 0 0 0 2.0094 3.0785 0.1184 O 0 0 0 0 0 0.1205 1.4802 0.7655 C 0 0 0 0 0 -0.6087 2.0070 -0.2845 C 0 0 0 0 0 -1.8715 1.5242 -0.5632 C 0 0 0 0 0 -2.4121 0.5021 0.2177 C 0 0 0 0 0 -3.7653 -0.0202 -0.0762 C 0 0 0 0 0 -4.4122 -1.0055 0.5941 N 0 0 0 0 0 -5.6523 -1.1405 -0.0541 N 0 0 0 0 0 -5.6675 -0.2794 -1.0136 N 0 0 0 0 0 -4.5706 0.3868 -1.0347 N 0 0 0 0 0 -1.6713 -0.0265 1.2751 C 0 0 0 0 0 -0.4104 0.4659 1.5437 C 0 0 0 0 0 0.5155 -0.1950 2.8554 CL 0 0 0 0 0 2.4340 -2.2818 -0.1886 H 0 0 0 0 0 5.8384 -1.5642 -0.4770 H 0 0 0 0 0 3.3649 1.0478 -1.1628 H 0 0 0 0 0 1.9770 -0.0278 -0.8659 H 0 0 0 0 0 3.3245 0.5050 1.5842 H 0 0 0 0 0 -0.1892 2.7979 -0.8891 H 0 0 0 0 0 -2.4402 1.9362 -1.3832 H 0 0 0 0 0 -4.0886 -1.5090 1.3577 H 0 0 0 0 0 -2.0851 -0.8173 1.8834 H 0 0 0 0 0 16 17 1 0 0 0 16 15 2 0 0 0 17 13 2 0 0 0 15 14 1 0 0 0 13 14 1 0 0 0 13 12 1 0 0 0 11 12 2 0 0 0 11 10 1 0 0 0 12 18 1 0 0 0 10 9 2 0 0 0 18 19 2 0 0 0 9 19 1 0 0 0 9 6 1 0 0 0 7 6 2 0 0 0 19 20 1 0 0 0 6 8 2 0 0 0 6 5 1 0 0 0 4 5 1 0 0 0 4 1 1 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 2 21 1 0 0 0 3 22 1 0 0 0 4 23 1 0 0 0 4 24 1 0 0 0 5 25 1 0 0 0 10 26 1 0 0 0 11 27 1 0 0 0 14 28 1 0 0 0 18 29 1 0 0 0 M END $$$$