BRN8J1 -OEChem-04012118212D 50 54 0 0 0 0 0 0 0999 V2000 3.3660 -1.1340 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5000 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -2.8660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8744 2.1953 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4580 3.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4580 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8744 3.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4580 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9580 3.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9580 2.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9580 3.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9580 2.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0670 4.3940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 2.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6480 4.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6480 1.5970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -3.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2680 4.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2680 1.5970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 2 32 1 0 0 0 0 3 32 1 0 0 0 0 4 24 2 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 6 13 2 0 0 0 0 7 12 1 0 0 0 0 7 20 2 0 0 0 0 8 17 1 0 0 0 0 8 24 1 0 0 0 0 8 42 1 0 0 0 0 9 33 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 16 2 0 0 0 0 11 15 2 0 0 0 0 11 18 1 0 0 0 0 12 14 2 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 35 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 16 20 1 0 0 0 0 16 37 1 0 0 0 0 17 21 2 0 0 0 0 18 22 2 0 0 0 0 18 38 1 0 0 0 0 19 25 2 0 0 0 0 19 26 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 27 2 0 0 0 0 23 29 1 0 0 0 0 25 33 1 0 0 0 0 25 43 1 0 0 0 0 26 34 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 30 2 0 0 0 0 28 32 1 0 0 0 0 29 31 2 0 0 0 0 29 46 1 0 0 0 0 30 31 1 0 0 0 0 30 47 1 0 0 0 0 31 48 1 0 0 0 0 33 49 1 0 0 0 0 34 50 1 0 0 0 0 M END $$$$