LGB3U2 -OEChem-05022323012D 43 43 0 1 0 0 0 0 0999 V2000 2.0000 -3.6550 0.0000 I 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.1550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.6550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.8450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.3450 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1550 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3301 2.8450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 3.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -0.0724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -0.7627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 1.1550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 2.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 3.3200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 3.3200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.5350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 18 2 0 0 0 0 3 19 1 0 0 0 0 3 40 1 0 0 0 0 4 20 1 0 0 0 0 4 41 1 0 0 0 0 5 19 2 0 0 0 0 6 20 2 0 0 0 0 7 23 1 0 0 0 0 7 42 1 0 0 0 0 8 26 1 0 0 0 0 8 43 1 0 0 0 0 9 23 2 0 0 0 0 12 10 1 6 0 0 0 10 18 1 0 0 0 0 10 33 1 0 0 0 0 13 11 1 6 0 0 0 11 18 1 0 0 0 0 11 34 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 12 27 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 13 28 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 17 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 21 2 0 0 0 0 16 22 1 0 0 0 0 17 23 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 21 24 1 0 0 0 0 21 37 1 0 0 0 0 22 25 2 0 0 0 0 22 38 1 0 0 0 0 24 26 2 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 M END $$$$