BA1CI5 -OEChem-04022107062D 57 59 0 0 0 0 0 0 0999 V2000 4.5981 4.7500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2500 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.7500 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.1962 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -2.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 -2.1674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -3.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -3.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -0.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 -1.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 5.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 5.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -5.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -5.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 17 1 0 0 0 0 1 32 1 0 0 0 0 2 13 2 0 0 0 0 5 20 2 0 0 0 0 6 10 1 0 0 0 0 7 10 2 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 13 1 0 0 0 0 9 16 1 0 0 0 0 9 20 1 0 0 0 0 9 41 1 0 0 0 0 10 19 1 0 0 0 0 11 14 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 15 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 16 1 0 0 0 0 14 21 2 0 0 0 0 14 23 1 0 0 0 0 15 22 2 0 0 0 0 15 24 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 19 2 0 0 0 0 17 26 1 0 0 0 0 18 20 1 0 0 0 0 18 25 2 0 0 0 0 18 27 1 0 0 0 0 19 25 1 0 0 0 0 21 28 1 0 0 0 0 21 43 1 0 0 0 0 22 29 1 0 0 0 0 22 44 1 0 0 0 0 23 30 2 0 0 0 0 23 45 1 0 0 0 0 24 31 2 0 0 0 0 24 46 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 33 2 0 0 0 0 28 52 1 0 0 0 0 29 34 2 0 0 0 0 29 53 1 0 0 0 0 30 33 1 0 0 0 0 30 54 1 0 0 0 0 31 34 1 0 0 0 0 31 55 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 33 56 1 0 0 0 0 34 57 1 0 0 0 0 M CHG 2 6 -1 10 1 M END $$$$