BKUG45 -OEChem-04012112222D 46 49 0 0 0 0 0 0 0999 V2000 3.6508 4.6649 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.6508 0.5957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1312 3.6303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6179 -1.4926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5209 -4.1675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9103 -3.1333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2652 2.1303 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3992 3.6303 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3992 1.6303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2652 1.1303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5332 1.1303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2652 0.1303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5332 0.1303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3992 -0.3697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5332 2.1303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5332 3.1303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6392 1.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2652 3.1303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6392 3.6650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7332 2.1095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7332 3.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7906 0.0857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8022 -0.9142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -2.4587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3199 -2.4472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 -3.2494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8758 1.0226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4773 1.7129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 1.7129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9226 1.0226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4773 -0.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8758 0.2379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9226 0.2379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 -0.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0007 -0.8447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7977 -0.8447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8022 1.8203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3992 4.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1974 1.7974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1974 3.4632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5718 0.6658 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1813 -0.0290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4082 -1.3266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9614 -2.9645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8911 -4.6649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 17 1 0 0 0 0 2 22 1 0 0 0 0 3 18 2 0 0 0 0 4 23 1 0 0 0 0 4 26 1 0 0 0 0 5 27 1 0 0 0 0 5 46 1 0 0 0 0 6 27 2 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 7 38 1 0 0 0 0 8 16 1 0 0 0 0 8 18 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 10 12 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 13 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 12 14 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 16 19 2 0 0 0 0 17 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 M END $$$$