NCI:74240 BBtclserve11129917132D 0 0.00000 0.00000 59566 1654-32-6 28 29 0 0 0 0 0 0 0 0 2 V2000 5.9703 0.9468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9921 0.7389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9484 1.1548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7624 1.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1782 -0.0313 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6831 -0.2121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2574 2.1058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6175 0.4116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8113 2.2340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5055 2.5941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9683 -0.6442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2709 -1.0211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2356 2.3137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6034 3.2121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8326 -1.6350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8942 -0.2664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6831 -1.8302 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5446 3.2648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6523 3.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.0212 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.5212 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.5212 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 1 0 0 0 0 1 5 1 0 0 0 0 2 6 1 0 0 0 0 3 7 1 0 0 0 0 3 8 2 0 0 0 0 4 9 1 0 0 0 0 4 10 2 0 0 0 0 5 11 1 0 0 0 0 6 12 1 0 0 0 0 6 13 2 0 0 0 0 7 14 1 0 0 0 0 9 15 1 0 0 0 0 11 16 1 0 0 0 0 11 17 2 0 0 0 0 12 18 2 0 0 0 0 12 19 1 0 0 0 0 13 20 1 0 0 0 0 14 21 1 0 0 0 0 15 22 1 0 0 0 0 18 23 1 0 0 0 0 19 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 1 0 0 0 0 18 20 1 0 0 0 0 24 26 1 0 0 0 0 M CHG 2 25 1 28 -1 M END