BNLO86 -OEChem-04012113112D 26 27 0 0 0 0 0 0 0999 V2000 3.7320 0.4806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5194 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.4806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 3.0194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0194 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4641 0.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6551 2.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 2.0684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -0.1020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 0.5882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0654 1.8768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8628 1.8768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5997 3.5210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 2 0 0 0 0 2 6 1 0 0 0 0 3 6 2 0 0 0 0 4 7 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 5 13 2 0 0 0 0 5 17 1 0 0 0 0 6 10 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 2 0 0 0 0 10 14 2 0 0 0 0 11 15 1 0 0 0 0 11 20 1 0 0 0 0 12 17 2 0 0 0 0 12 21 1 0 0 0 0 13 22 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 M CHG 2 2 -1 6 1 M END $$$$