BA2M3B -OEChem-04022105322D 85 89 0 1 0 0 0 0 0999 V2000 3.0000 1.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9282 2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5263 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6603 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.5000 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.1340 -3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 3.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8660 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 2.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4641 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7942 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6603 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 2.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4766 3.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0781 4.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3985 4.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6015 4.9750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5234 3.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9219 2.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9219 4.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5234 3.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8535 1.6077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2520 0.9174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 0.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9407 0.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5422 1.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 1.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7932 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 5.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9272 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7331 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5991 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7331 -1.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1928 3.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3957 3.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -5.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9781 -3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -3.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2181 -3.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8862 -4.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7331 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5062 -2.9631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0632 2.6900 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 11 1 0 0 0 0 1 20 1 0 0 0 0 2 19 1 0 0 0 0 21 2 1 1 0 0 0 5 19 2 0 0 0 0 6 33 1 0 0 0 0 6 42 1 0 0 0 0 7 39 1 0 0 0 0 7 46 1 0 0 0 0 8 41 1 0 0 0 0 8 48 1 0 0 0 0 9 47 1 0 0 0 0 9 85 1 0 0 0 0 10 47 2 0 0 0 0 11 14 1 0 0 0 0 11 17 1 0 0 0 0 12 37 2 0 0 0 0 12 43 1 0 0 0 0 13 37 1 0 0 0 0 13 44 2 0 0 0 0 14 15 1 0 0 0 0 14 19 1 1 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 15 51 1 0 0 0 0 16 18 1 0 0 0 0 16 52 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 20 23 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 21 58 1 0 0 0 0 22 26 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 23 27 1 0 0 0 0 23 61 1 0 0 0 0 24 28 2 0 0 0 0 24 62 1 0 0 0 0 25 31 2 0 0 0 0 25 32 1 0 0 0 0 26 30 1 0 0 0 0 26 63 1 0 0 0 0 26 64 1 0 0 0 0 27 29 2 0 0 0 0 27 65 1 0 0 0 0 28 29 1 0 0 0 0 28 66 1 0 0 0 0 29 37 1 0 0 0 0 30 35 2 0 0 0 0 30 36 1 0 0 0 0 31 33 1 0 0 0 0 31 67 1 0 0 0 0 32 34 2 0 0 0 0 32 68 1 0 0 0 0 33 38 2 0 0 0 0 34 38 1 0 0 0 0 34 69 1 0 0 0 0 35 39 1 0 0 0 0 35 70 1 0 0 0 0 36 40 2 0 0 0 0 36 71 1 0 0 0 0 38 72 1 0 0 0 0 39 41 2 0 0 0 0 40 41 1 0 0 0 0 40 73 1 0 0 0 0 42 47 1 0 0 0 0 42 74 1 0 0 0 0 42 75 1 0 0 0 0 43 45 2 0 0 0 0 43 76 1 0 0 0 0 44 45 1 0 0 0 0 44 77 1 0 0 0 0 45 78 1 0 0 0 0 46 79 1 0 0 0 0 46 80 1 0 0 0 0 46 81 1 0 0 0 0 48 82 1 0 0 0 0 48 83 1 0 0 0 0 48 84 1 0 0 0 0 M END $$$$