BBR5M7 -OEChem-04012116182D 49 52 0 0 0 0 0 0 0999 V2000 12.5734 -1.1535 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.9336 0.1077 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.9551 -0.0985 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8959 -2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3122 -3.4028 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 -3.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 1.8660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 2.7320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3660 -2.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 -1.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3122 -1.7933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3660 -3.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6340 -2.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 0.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6229 -0.8428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6340 -3.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 2.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 3.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 3.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0970 -1.7881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6900 -1.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1200 0.1340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5159 -2.5981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8800 0.1340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3100 1.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0970 -3.4081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8923 0.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5826 0.7879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 1.3291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8100 2.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 2.7320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3100 3.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8100 4.1350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 4.1350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 2 19 1 0 0 0 0 3 19 1 0 0 0 0 4 29 2 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 5 35 1 0 0 0 0 6 14 2 0 0 0 0 7 14 1 0 0 0 0 7 22 2 0 0 0 0 8 18 1 0 0 0 0 8 29 1 0 0 0 0 8 42 1 0 0 0 0 9 25 1 0 0 0 0 9 29 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 19 1 0 0 0 0 15 22 1 0 0 0 0 15 32 1 0 0 0 0 16 20 1 0 0 0 0 16 33 1 0 0 0 0 17 21 2 0 0 0 0 17 34 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 26 2 0 0 0 0 23 27 1 0 0 0 0 24 31 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 28 2 0 0 0 0 26 41 1 0 0 0 0 27 30 2 0 0 0 0 27 43 1 0 0 0 0 28 30 1 0 0 0 0 28 45 1 0 0 0 0 30 46 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 M END $$$$