BM91ZH -OEChem-04012118282D 56 59 0 1 0 0 0 0 0999 V2000 4.9889 -2.6565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 1.0602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.9013 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3211 1.5983 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.0965 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7320 -0.4013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -0.9013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6318 2.5488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.7060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.8540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.0987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9424 3.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6812 2.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5823 2.2382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -1.7673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -2.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 -0.9013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 -2.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 -3.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -3.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 -0.9013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 -0.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 -0.0352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 0.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 0.8308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2908 -0.0003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8445 -0.6892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1542 -0.2907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7144 1.4704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.7187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5317 3.3067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 4.0887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3531 3.6920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8738 3.4488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0919 3.0521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4886 2.2702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3897 1.6488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1716 2.0455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7749 2.8275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.0913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.7113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6419 -2.6333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8819 -2.6333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4519 -4.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0719 -4.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5719 -1.4382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1419 -0.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3819 -0.0352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9519 1.3677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5719 1.3677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 2 0 0 0 0 2 11 2 0 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 3 10 1 0 0 0 0 4 9 1 0 0 0 0 4 11 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 13 2 0 0 0 0 7 10 1 0 0 0 0 7 14 2 0 0 0 0 8 12 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 12 18 1 0 0 0 0 12 21 2 0 0 0 0 13 19 1 0 0 0 0 13 35 1 0 0 0 0 14 20 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 22 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 21 24 1 0 0 0 0 21 48 1 0 0 0 0 22 26 2 0 0 0 0 22 27 1 0 0 0 0 23 25 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 26 28 1 0 0 0 0 26 52 1 0 0 0 0 27 29 2 0 0 0 0 27 53 1 0 0 0 0 28 30 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 M END $$$$