BT3IN5 -OEChem-04012114352D 50 54 0 0 0 0 0 0 0999 V2000 11.8600 1.5972 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.5835 -2.3910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9192 -0.9024 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0972 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 2.4019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5972 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5870 -0.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2298 -1.8529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9407 -0.6961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 0.7925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5620 -2.5972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2728 -1.4404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 1.5972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.0972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8600 1.5972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.5972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3600 2.4632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3600 0.7312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3600 2.4632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3600 0.7312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8600 1.5972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9696 -0.6460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1339 0.1340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6124 -2.3408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7768 -1.5609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1719 -0.1209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4143 -0.3685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3307 -3.1724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0883 -2.9248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8903 -0.9525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7259 -1.7325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.2172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 2.4072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0500 3.0002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0500 0.1942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6700 3.0002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6700 0.1942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.7172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.7128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.9072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.7128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 14 1 0 0 0 0 5 13 1 0 0 0 0 5 14 2 0 0 0 0 6 17 2 0 0 0 0 7 10 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 11 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 12 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 13 2 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 18 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 41 1 0 0 0 0 19 22 1 0 0 0 0 19 42 1 0 0 0 0 20 23 2 0 0 0 0 20 43 1 0 0 0 0 21 25 2 0 0 0 0 21 26 1 0 0 0 0 22 24 2 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 25 27 1 0 0 0 0 25 46 1 0 0 0 0 26 28 2 0 0 0 0 26 47 1 0 0 0 0 27 29 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 50 1 0 0 0 0 M END $$$$