BTOA20 -OEChem-04022103052D 44 46 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 10.5769 0.0098 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 7.0747 0.0060 0.0000 N 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 5.3147 2.0407 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 11.4448 0.5065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3128 1.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9415 -0.3615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9482 1.3744 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 6.1808 0.5407 0.0000 C 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 7.9808 0.5198 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 3.5827 0.0407 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 7.9808 1.5615 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 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 2.6691 0.4474 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 12.6207 0.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8509 1.3111 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0049 1.5413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4034 -0.6694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2494 -0.8996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4796 -0.0535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4863 1.6824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6403 1.9126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4101 1.0665 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 8.8425 -0.6035 0.0000 H 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 8.5165 1.8735 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 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 2.5402 1.0538 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 1 12 2 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 2 34 1 0 0 0 0 3 12 1 0 0 0 0 3 15 1 0 0 0 0 3 35 1 0 0 0 0 4 13 1 0 0 0 0 4 15 2 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 5 24 1 0 0 0 0 6 16 1 0 0 0 0 6 21 2 0 0 0 0 7 23 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 13 16 2 0 0 0 0 13 18 1 0 0 0 0 14 17 1 0 0 0 0 14 18 2 0 0 0 0 14 21 1 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 17 22 2 0 0 0 0 17 23 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END $$$$