BR4T1A -OEChem-04012118442D 35 37 0 0 0 0 0 0 0999 V2000 5.4641 -2.4806 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.0194 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6551 -4.0684 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4806 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 -4.0684 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 -5.0194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 -5.0194 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5194 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 -3.4806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.5194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 -3.7594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -1.8729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -2.5632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.7094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.8294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8956 -3.1697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1144 -3.5678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5124 -4.3490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.7094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 18 1 0 0 0 0 2 22 1 0 0 0 0 3 13 1 0 0 0 0 3 15 1 0 0 0 0 3 26 1 0 0 0 0 4 14 1 0 0 0 0 4 15 2 0 0 0 0 5 9 1 0 0 0 0 5 18 1 0 0 0 0 5 23 1 0 0 0 0 6 14 2 0 0 0 0 6 19 1 0 0 0 0 7 15 1 0 0 0 0 7 19 2 0 0 0 0 8 11 1 0 0 0 0 8 18 2 0 0 0 0 9 11 2 0 0 0 0 10 19 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 16 20 1 0 0 0 0 16 27 1 0 0 0 0 17 21 2 0 0 0 0 17 28 1 0 0 0 0 20 22 2 0 0 0 0 20 29 1 0 0 0 0 21 22 1 0 0 0 0 21 30 1 0 0 0 0 23 31 1 0 0 0 0 23 32 1 0 0 0 0 23 33 1 0 0 0 0 M END $$$$