B5VKU3 -OEChem-04022109102D 44 47 0 0 0 0 0 0 0999 V2000 2.0000 -4.5600 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.5600 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 3.4747 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 1.9192 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4920 1.4053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 2.9608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.1677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -0.1677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 0.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -0.9523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -1.6426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -1.6426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -0.9523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 3.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4848 0.7854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -4.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9338 3.2729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 4.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 2 25 1 0 0 0 0 3 26 2 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 4 13 1 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 5 14 1 0 0 0 0 6 17 1 0 0 0 0 6 27 2 0 0 0 0 7 22 2 0 0 0 0 7 27 1 0 0 0 0 8 26 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 16 21 2 0 0 0 0 16 36 1 0 0 0 0 17 20 2 0 0 0 0 18 23 1 0 0 0 0 18 37 1 0 0 0 0 19 24 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 23 25 2 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 27 42 1 0 0 0 0 M END $$$$