BRJ7B6 -OEChem-04022105512D 44 47 0 1 0 0 0 0 0999 V2000 2.5000 -1.5691 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.2969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.7969 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0411 -3.1569 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4230 -3.1569 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 1.4309 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7320 2.2969 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7320 2.2969 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2320 0.4309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 2.7969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -0.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 -0.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 2.2969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 3.7969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -1.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 -1.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 2.7969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 4.2969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -1.5691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 3.7969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -2.5691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -4.1079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.1079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3198 -4.9169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8309 1.2704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5716 2.8958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8925 2.8958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8291 0.2409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6350 0.2409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 1.6769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0611 4.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 4.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6350 -1.3791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8671 2.4869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 4.9169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8671 4.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.9169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6307 -2.9653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3676 -4.6095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8182 -5.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6843 -5.4185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8214 -4.5525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 12 2 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 4 12 1 0 0 0 0 4 34 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 5 40 1 0 0 0 0 6 23 2 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 1 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 6 0 0 0 8 28 1 0 0 0 0 9 12 1 6 0 0 0 9 29 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 13 17 1 0 0 0 0 13 30 1 0 0 0 0 14 18 2 0 0 0 0 14 31 1 0 0 0 0 15 19 1 0 0 0 0 15 32 1 0 0 0 0 16 20 2 0 0 0 0 16 33 1 0 0 0 0 17 21 2 0 0 0 0 18 21 1 0 0 0 0 18 35 1 0 0 0 0 19 22 2 0 0 0 0 19 36 1 0 0 0 0 20 22 1 0 0 0 0 20 37 1 0 0 0 0 21 23 1 0 0 0 0 22 38 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END $$$$