BO3CM2 -OEChem-04012115532D 51 54 0 0 0 0 0 0 0999 V2000 14.8527 0.6644 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.7095 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5622 -1.5755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5622 0.1565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1901 -1.7095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.2905 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6065 -2.5142 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.2095 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9171 0.0458 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8956 0.2520 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -2.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6065 -0.9048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1901 -1.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.7905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2063 1.2025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1848 1.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5385 1.9468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4955 2.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8491 2.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8276 3.1035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.0895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3913 -2.5195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.3295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7991 -3.1035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.4105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9316 -1.1844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 -1.1844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.1005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.5195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.9105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5001 -2.2464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9318 1.8190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.3274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.4805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 0.2536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1021 2.4871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4351 3.3588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0202 3.6929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 5 19 1 0 0 0 0 5 44 1 0 0 0 0 6 25 1 0 0 0 0 6 29 1 0 0 0 0 7 13 1 0 0 0 0 7 19 1 0 0 0 0 7 36 1 0 0 0 0 8 18 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 26 1 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 12 14 2 0 0 0 0 12 16 1 0 0 0 0 13 17 1 0 0 0 0 14 33 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 18 20 1 0 0 0 0 18 38 1 0 0 0 0 18 39 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 40 1 0 0 0 0 22 24 2 0 0 0 0 22 41 1 0 0 0 0 23 25 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 27 30 2 0 0 0 0 28 31 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 30 32 1 0 0 0 0 30 49 1 0 0 0 0 31 32 2 0 0 0 0 31 50 1 0 0 0 0 32 51 1 0 0 0 0 M END $$$$