BW6SN2 -OEChem-04012117312D 47 48 0 1 0 0 0 0 0999 V2000 8.9446 2.9476 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.0869 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 0.7791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 -0.9530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.4130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5869 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 0.3922 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9446 -1.1215 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7932 -2.6315 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6765 -1.1416 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0869 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0000 -1.0870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 0.2791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -1.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.9131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.4131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.0869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.4130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.4131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.4130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.9130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9561 -0.1216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9561 1.9477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 1.4339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8047 -1.6315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -0.5500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.3970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -1.6239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 0.5891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 0.8160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8291 -0.0309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8291 -1.7630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -1.9899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 -1.1430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.7069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 1.7230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.5330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3979 1.7459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3265 -2.9476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2527 -2.9352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2098 -1.4578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6837 -0.5216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 7 1 0 0 0 0 2 18 1 0 0 0 0 3 17 1 0 0 0 0 3 42 1 0 0 0 0 6 17 2 0 0 0 0 13 7 1 6 0 0 0 7 38 1 0 0 0 0 8 24 2 0 0 0 0 8 26 1 0 0 0 0 9 24 1 0 0 0 0 9 27 2 0 0 0 0 10 27 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 27 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 19 39 1 0 0 0 0 20 23 2 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 41 1 0 0 0 0 25 26 2 0 0 0 0 26 43 1 0 0 0 0 M END $$$$