BA3GB9 -OEChem-04022106202D 38 40 0 0 0 0 0 0 0999 V2000 4.5981 -2.0222 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 -2.8883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 -1.1562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0727 3.0223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3408 3.0023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5223 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 -0.5569 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2241 1.5124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 0.9986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.5222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.0431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2125 2.5123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.0222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.5222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0611 4.0222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.8322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -0.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.0978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.2878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6659 1.3106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.8322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6659 -0.3551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.2122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.6422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.8322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6811 4.0294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0540 4.6422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4412 4.0151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 6 1 0 0 0 0 1 12 1 0 0 0 0 4 20 1 0 0 0 0 4 24 1 0 0 0 0 5 20 2 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 7 9 2 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 16 1 0 0 0 0 11 20 1 0 0 0 0 12 17 2 0 0 0 0 12 18 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 16 19 2 0 0 0 0 16 29 1 0 0 0 0 17 21 1 0 0 0 0 17 30 1 0 0 0 0 18 22 2 0 0 0 0 18 31 1 0 0 0 0 19 32 1 0 0 0 0 21 23 2 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 M END $$$$