B9GHI3 -OEChem-04012116222D 45 47 0 1 0 0 0 0 0999 V2000 4.7320 3.8660 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1340 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 2.1340 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.8660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.1340 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2320 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7571 3.3985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7571 2.6015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 2.1709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 1.3240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 1.0970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8397 4.4766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1494 4.0781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.9440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.6760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -0.9737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -0.2834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -2.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 3.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 2.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -3.6760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.4860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -2.0560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6182 -4.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -4.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2382 -3.3291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 16 1 0 0 0 0 2 14 1 0 0 0 0 3 19 1 0 0 0 0 4 8 1 0 0 0 0 4 16 2 0 0 0 0 5 18 1 0 0 0 0 5 20 1 0 0 0 0 5 37 1 0 0 0 0 6 16 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 20 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 1 0 0 0 9 12 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 13 1 0 0 0 0 10 14 2 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 15 2 0 0 0 0 13 33 1 0 0 0 0 14 17 1 0 0 0 0 15 18 1 0 0 0 0 15 19 1 0 0 0 0 17 19 2 0 0 0 0 17 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 M END $$$$