NCI:667633 BBtclserve11129920112D 0 0.00000 0.00000234219 Corina 01.500030 20.12.1994 51 53 0 0 0 0 0 0 0 0 1 V2000 4.5981 -7.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -7.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.2500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 0.3840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 2.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -0.3840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -2.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -5.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -8.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -7.7500 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 7.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 7.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 7.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3302 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 6.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8661 5.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8661 7.7500 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 8.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0622 0.0000 0.0000 Na 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 35 1 0 0 0 0 5 6 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 33 1 0 0 0 0 11 12 2 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 17 43 1 0 0 0 0 17 18 2 0 0 0 0 19 35 2 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 33 34 2 0 0 0 0 37 38 2 0 0 0 0 37 42 1 0 0 0 0 38 39 1 0 0 0 0 38 50 1 0 0 0 0 39 40 2 0 0 0 0 39 49 1 0 0 0 0 40 41 1 0 0 0 0 40 47 1 0 0 0 0 41 48 1 0 0 0 0 41 42 2 0 0 0 0 42 44 1 0 0 0 0 43 48 2 0 0 0 0 44 45 2 0 0 0 0 44 46 1 0 0 0 0 M END