NCI:48776 BBtclserve11129917032D 0 0.00000 0.00000 41861 6639-77-6 30 31 0 0 0 0 0 0 0 0 1 V2000 5.4641 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.2500 0.0000 N 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 6.3301 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 5.2500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 6.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7321 5.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7321 5.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -5.2500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0621 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6602 -5.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2942 -6.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2942 -4.3840 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0621 -6.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 4 7 1 0 0 0 0 5 8 1 0 0 0 0 6 9 2 0 0 0 0 7 10 1 0 0 0 0 7 11 2 0 0 0 0 8 12 1 0 0 0 0 8 13 2 0 0 0 0 10 14 1 0 0 0 0 12 15 2 0 0 0 0 12 16 2 0 0 0 0 12 17 1 0 0 0 0 13 18 1 0 0 0 0 14 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 2 0 0 0 0 23 25 1 0 0 0 0 23 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 2 0 0 0 0 25 29 1 0 0 0 0 26 30 1 0 0 0 0 9 13 1 0 0 0 0 24 26 1 0 0 0 0 M END