BHM3O5 -OEChem-04022102062D 48 51 0 1 0 0 0 0 0999 V2000 3.6275 2.8933 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1012 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8185 1.4921 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.1012 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4641 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6882 -0.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6882 1.9334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 0.3780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5942 1.4196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6494 3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1494 2.2352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -1.6838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -0.9936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 1.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6810 -0.7558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6810 2.5534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1300 0.0659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1300 1.7317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3972 3.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5328 2.1704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 21 1 0 0 0 0 3 11 2 0 0 0 0 4 12 2 0 0 0 0 8 5 1 6 0 0 0 5 12 1 0 0 0 0 5 34 1 0 0 0 0 6 11 1 0 0 0 0 6 28 1 0 0 0 0 6 39 1 0 0 0 0 7 28 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 15 2 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 13 17 2 0 0 0 0 13 19 1 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 14 23 2 0 0 0 0 15 21 1 0 0 0 0 15 35 1 0 0 0 0 16 22 2 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 18 20 1 0 0 0 0 18 24 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 40 1 0 0 0 0 21 25 2 0 0 0 0 22 25 1 0 0 0 0 22 41 1 0 0 0 0 23 26 1 0 0 0 0 23 42 1 0 0 0 0 24 27 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 29 30 2 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 M END $$$$