B3LEO0 -OEChem-04022102292D 49 51 0 1 0 0 0 0 0999 V2000 3.4641 4.9979 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 6.9979 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 4.9979 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.8635 1.7320 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.4975 0.3660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.8635 0.0000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.0956 0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2295 2.3660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 7.9979 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.5981 8.4979 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 7.9979 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 9.9979 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6882 7.9633 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6882 10.0326 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 6.9979 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4641 7.9979 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3301 6.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 8.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 6.9979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 6.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 8.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 5.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 6.9979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 9.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 6.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 4.9979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 5.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 8.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 9.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5942 8.4771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5942 9.5187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3635 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2295 1.3660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 6.3779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9272 7.6879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9316 6.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7287 6.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7287 8.9729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9316 8.9729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4082 6.4153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8067 7.1056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 9.1179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0611 8.1879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 7.6179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5252 9.8079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 4.3779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1300 8.1650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1300 9.8308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6325 1.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 25 1 0 0 0 0 3 27 1 0 0 0 0 4 32 1 0 0 0 0 5 32 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 7 49 1 0 0 0 0 8 33 2 0 0 0 0 9 18 1 0 0 0 0 9 19 1 0 0 0 0 9 21 1 0 0 0 0 16 10 1 1 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 21 2 0 0 0 0 11 28 1 0 0 0 0 12 24 2 0 0 0 0 12 29 1 0 0 0 0 13 28 2 0 0 0 0 13 30 1 0 0 0 0 14 29 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 6 0 0 0 15 34 1 0 0 0 0 16 18 1 0 0 0 0 16 35 1 0 0 0 0 17 19 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 22 1 0 0 0 0 20 23 2 0 0 0 0 21 24 1 0 0 0 0 22 26 2 0 0 0 0 23 25 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 25 27 2 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 28 29 1 0 0 0 0 30 31 2 0 0 0 0 30 47 1 0 0 0 0 31 48 1 0 0 0 0 32 33 1 0 0 0 0 M END $$$$