BR9Y1K -OEChem-04012114322D 55 58 0 0 0 0 0 0 0999 V2000 7.9939 1.1651 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.6651 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 3.1651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9939 -0.5670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 1.9698 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4103 0.3603 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.1651 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 12.9939 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4939 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4939 0.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4939 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4939 0.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9939 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9939 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4939 0.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4939 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4939 0.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9939 -2.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4939 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4939 -3.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9939 -2.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4939 -3.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 1.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3039 -0.0301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3863 -2.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0765 -1.6451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0765 0.5111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3863 0.9096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9113 -1.6451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6016 -2.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6016 0.9096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9113 0.5111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5765 -0.3549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8863 0.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4113 -0.7790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1016 -1.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0765 0.5111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3863 0.9096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9113 0.0870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6016 -0.3115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3739 -2.2990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8039 -0.8961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1839 -3.7020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6139 -2.2990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8039 -3.7020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6029 2.5591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.7851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.4549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.3551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 23 1 0 0 0 0 2 7 1 0 0 0 0 3 7 2 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 4 14 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 5 52 1 0 0 0 0 6 23 2 0 0 0 0 6 25 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 8 30 1 0 0 0 0 9 11 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 16 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 17 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 20 1 0 0 0 0 18 47 1 0 0 0 0 19 21 2 0 0 0 0 19 48 1 0 0 0 0 20 22 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 28 2 0 0 0 0 26 53 1 0 0 0 0 27 29 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 29 55 1 0 0 0 0 M CHG 2 2 -1 7 1 M END $$$$