BT2R3E -OEChem-04042102523D 28 29 0 0 0 0 0 0 0999 V2000 -2.2624 2.5252 -0.5085 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9958 -1.3771 -0.3067 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3158 1.6404 0.0004 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3915 -1.2117 -0.1132 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0956 -0.5208 -0.1061 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9692 0.0507 -0.2501 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3412 0.2144 -0.0593 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1862 -2.3103 0.2147 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1358 -0.8843 0.2685 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5583 -2.1466 0.4052 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2321 -0.6466 -0.9051 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0481 0.4538 0.8907 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3212 0.2024 -0.7072 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1372 1.3027 1.0886 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9431 1.5308 -0.2012 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2736 1.1772 0.2894 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2513 -2.2951 -0.6601 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 0.9047 -0.5285 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7478 -3.2989 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2056 -0.8315 0.4305 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1761 -3.0028 0.6604 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2808 -1.4014 -1.6858 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1854 0.5603 1.5426 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2061 0.1046 -1.3292 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1026 2.0583 1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1219 1.8375 0.4441 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9428 0.8858 0.2476 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7612 2.5473 -0.0995 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 2 17 1 0 0 0 0 3 15 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 6 1 0 0 0 0 4 8 2 0 0 0 0 5 11 2 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 6 18 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 21 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 12 14 2 0 0 0 0 12 23 1 0 0 0 0 13 16 2 0 0 0 0 13 24 1 0 0 0 0 14 16 1 0 0 0 0 14 25 1 0 0 0 0 16 26 1 0 0 0 0 M END $$$$