NCI:405850 BBtclserve11129919262D 0 0.00000 0.00000196103 7598-96-1 22 24 0 0 0 0 0 0 0 0 2 V2000 4.5981 0.0945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.5945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5686 1.5890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3777 0.1878 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.4055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5468 1.7970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8255 2.2582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.9309 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.4055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.4055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8744 1.9492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0334 3.2363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9055 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1313 2.6183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2903 3.9055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.9055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4055 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3392 3.5965 0.0000 C 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 1 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 2 0 0 0 0 4 7 2 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 11 1 0 0 0 0 7 12 1 0 0 0 0 8 13 2 0 0 0 0 10 14 2 0 0 0 0 10 15 1 0 0 0 0 12 16 1 0 0 0 0 12 17 2 0 0 0 0 14 18 1 0 0 0 0 15 19 2 0 0 0 0 16 20 2 0 0 0 0 16 21 1 0 0 0 0 18 22 2 0 0 0 0 9 11 1 0 0 0 0 13 17 1 0 0 0 0 19 22 1 0 0 0 0 M CHG 2 16 1 21 -1 M END