BMC31A -OEChem-04022102572D 45 48 0 0 0 0 0 0 0999 V2000 9.7166 1.5132 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -1.1618 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0747 0.0060 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 2.0407 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8448 0.0165 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5769 0.0098 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2957 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 0.5407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 0.5407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 0.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.5407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 1.5407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 -0.9539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9808 0.5198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0747 2.0753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4448 0.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 0.4474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9808 1.5615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3089 0.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7128 0.5132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0933 -2.0753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3051 -0.9968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1769 0.4998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1692 -1.5002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0410 -0.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0371 -1.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.5793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 1.8507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9389 -1.3687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0675 2.6953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8452 0.9799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0481 0.9830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5402 1.0538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5165 1.8735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8425 -0.6035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5745 -0.6102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5269 -1.8231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8411 -2.6417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6597 -2.3275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7669 -1.3048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1793 1.1198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1668 -2.1202 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5791 0.3044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5728 -1.3156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 2 0 0 0 0 2 7 1 0 0 0 0 2 14 1 0 0 0 0 2 22 1 0 0 0 0 3 9 1 0 0 0 0 3 15 2 0 0 0 0 4 11 1 0 0 0 0 4 13 2 0 0 0 0 5 15 1 0 0 0 0 5 21 1 0 0 0 0 5 36 1 0 0 0 0 6 17 1 0 0 0 0 6 21 1 0 0 0 0 6 37 1 0 0 0 0 7 18 2 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 14 2 0 0 0 0 10 18 1 0 0 0 0 11 16 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 14 30 1 0 0 0 0 15 19 1 0 0 0 0 16 19 2 0 0 0 0 16 31 1 0 0 0 0 17 20 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 25 1 0 0 0 0 23 41 1 0 0 0 0 24 26 2 0 0 0 0 24 42 1 0 0 0 0 25 27 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 M END $$$$