BHS53B -OEChem-04022102322D 45 47 0 1 0 0 0 0 0999 V2000 8.2788 1.6012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0249 -0.5432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4128 3.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7378 -1.7021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.3988 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.3389 2.5794 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5468 1.6012 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3776 -0.0080 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0468 0.7352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5686 1.3933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4128 2.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 -0.7511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0132 -0.5095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4616 0.2744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5484 1.0996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5038 2.0099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9486 1.3933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7492 2.7710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7996 2.9942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8158 1.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4398 -1.0039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.5188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.0888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 38 1 0 0 0 0 2 13 1 0 0 0 0 2 39 1 0 0 0 0 3 12 2 0 0 0 0 4 13 2 0 0 0 0 5 8 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 7 6 1 6 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 6 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 11 31 1 0 0 0 0 14 16 2 0 0 0 0 14 18 1 0 0 0 0 15 17 2 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 16 34 1 0 0 0 0 17 21 1 0 0 0 0 17 35 1 0 0 0 0 18 22 2 0 0 0 0 18 36 1 0 0 0 0 19 23 2 0 0 0 0 19 37 1 0 0 0 0 20 24 2 0 0 0 0 20 40 1 0 0 0 0 21 25 2 0 0 0 0 21 41 1 0 0 0 0 22 24 1 0 0 0 0 22 42 1 0 0 0 0 23 25 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 M END $$$$