BSH2Q1 -OEChem-04012119192D 44 46 0 0 0 0 0 0 0999 V2000 8.9942 -1.4829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 0.0171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 -1.4829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 1.5171 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 2.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 0.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1282 -0.9829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 0.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 0.5171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7263 0.5171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3282 -1.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2342 -1.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2342 0.5517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 3.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4583 1.5171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3282 0.0379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8602 -0.9829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5961 -1.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -1.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7359 -2.5137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 -3.0171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0038 -2.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 1.3971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9942 1.1371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1893 1.8271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2414 -2.1375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2414 1.1717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2123 3.0171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5923 3.6371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9723 3.0171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1483 0.9801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9952 1.2071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7683 2.0540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7924 0.3500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9928 -0.5339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1958 -0.5370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8617 -0.3971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2740 -2.8217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 -1.2125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8742 -3.6371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4681 -2.8325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 18 1 0 0 0 0 2 12 1 0 0 0 0 2 19 1 0 0 0 0 3 11 2 0 0 0 0 4 18 2 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 28 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 7 14 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 10 27 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 29 1 0 0 0 0 14 17 2 0 0 0 0 14 30 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 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 25 44 1 0 0 0 0 M END $$$$