BP95FO -OEChem-04022110362D 43 46 0 0 0 0 0 0 0999 V2000 12.9601 -0.1388 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.5274 2.4468 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3923 -0.8242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6907 0.7402 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7328 0.3319 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3518 2.0913 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0547 1.3226 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0443 -0.9554 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3424 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3219 0.3319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0274 0.9080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.3226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7029 2.0913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7183 1.8590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0274 0.9080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3364 1.8590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7123 0.1232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3991 -0.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 -0.2096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0232 -0.7512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6895 -1.4969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3359 0.1986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6684 -1.2928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3768 -2.4468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3149 0.4028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9811 -0.3429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1160 -0.4540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8724 -0.1985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7081 0.2441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3034 -0.2878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6208 1.8131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4518 1.0329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9426 2.6631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1806 2.4252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8720 -0.7403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6291 -0.9895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8504 -1.5443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9228 0.6610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0815 -1.7552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7879 -2.2529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1830 -3.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9657 -2.6407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5087 0.9917 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 14 1 0 0 0 0 2 16 1 0 0 0 0 3 17 2 0 0 0 0 4 19 2 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 6 7 2 0 0 0 0 6 16 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 25 2 0 0 0 0 22 38 1 0 0 0 0 23 26 2 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$