NCI:359282 BBtclserve11129919152D 0 0.00000 0.00000183295 85318-76-9 20 21 0 0 0 0 0 0 0 0 2 V2000 3.9538 0.0901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5471 1.0036 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9483 -0.0144 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -0.7189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1349 1.8126 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6751 -1.6700 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 -0.7189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7281 2.7262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 -1.6700 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3159 3.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9092 4.4488 0.0000 S 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 -3.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4970 5.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9147 4.5533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -4.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.2578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 2 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 2 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 8 11 1 0 0 0 0 9 12 1 0 0 0 0 11 13 1 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 15 19 2 0 0 0 0 18 20 2 0 0 0 0 9 10 1 0 0 0 0 19 20 1 0 0 0 0 M CHG 1 13 1 M END