B6LQJ1 -OEChem-04012117542D 43 45 0 1 0 0 0 0 0999 V2000 6.5211 -3.1500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8562 -5.1717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0834 -1.5241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2273 1.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5701 -4.4590 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8562 -2.7463 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6721 -0.1070 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5701 -3.4590 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5618 -3.4549 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5618 -4.4632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5211 -4.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1089 -3.9590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1170 -1.7809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4113 -1.0724 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4449 -1.3292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9665 0.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5216 2.2755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7824 3.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7489 3.4978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0768 3.9495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0097 4.4632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3376 4.9149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 5.1717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4388 -2.6192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9888 -3.6915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2690 -5.3344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0581 -5.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5697 -4.3739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5697 -3.5442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2569 -2.9056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0105 -0.9131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2856 -0.7300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8456 -1.4884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6041 -1.9284 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2713 0.0523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9602 2.5387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 1.7684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1864 3.0585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4776 3.7902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6089 4.6224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9001 5.3542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4657 5.7703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 11 2 0 0 0 0 3 14 2 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 17 2 0 0 0 0 6 9 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 10 7 1 1 0 0 0 7 14 1 0 0 0 0 7 31 1 0 0 0 0 15 8 1 6 0 0 0 8 17 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 6 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 39 1 0 0 0 0 21 23 2 0 0 0 0 21 40 1 0 0 0 0 22 24 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 M END $$$$