B4U2AL -OEChem-04012115012D 54 55 0 1 0 0 0 0 0999 V2000 3.0000 1.8450 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 4.3450 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 3.3450 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 5.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 4.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 1.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -5.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 3.3450 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7320 2.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 3.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 2.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 3.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 2.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -5.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 2.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3335 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1306 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9966 3.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1996 3.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0656 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8626 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 3.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7287 3.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9316 3.8200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7976 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5947 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 5.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 4.8819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 0.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 0.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -0.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -2.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -2.3450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -3.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -3.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -5.1181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -5.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 -6.1919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 1 8 2 0 0 0 0 1 10 1 0 0 0 0 1 16 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 2 6 2 0 0 0 0 2 11 1 0 0 0 0 3 17 1 0 0 0 0 4 42 1 0 0 0 0 5 43 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 11 10 1 1 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 17 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 21 1 0 0 0 0 18 44 1 0 0 0 0 19 22 2 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 24 48 1 0 0 0 0 25 27 2 0 0 0 0 25 49 1 0 0 0 0 26 28 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 M END $$$$