NCI:668604 BBtclserve11129920122D 0 0.00000 0.00000234785 999-99-9 40 43 0 0 0 0 0 0 0 0 2 V2000 2.0000 4.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 5.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 4.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6831 5.5705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2709 4.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6831 3.9524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9921 6.5215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9703 6.7294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2793 7.6805 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.2574 7.8884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6101 8.4236 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.9921 3.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9703 2.7935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2793 1.8424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2575 1.6345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5665 0.6834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5446 0.4755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8536 -0.4755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8318 -0.6834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1408 -1.6345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1190 -1.8424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4280 -2.7935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4061 -3.0014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3983 -4.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3983 -5.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5322 -5.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6662 -5.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6662 -4.2614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5322 -3.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7152 -5.5705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1274 -4.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7151 -3.9524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4061 -6.5215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4280 -6.7294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1190 -7.6805 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.1408 -7.8884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7881 -8.4236 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 1 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 5 9 1 0 0 0 0 7 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 9 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 27 32 1 0 0 0 0 30 33 1 0 0 0 0 33 34 2 0 0 0 0 26 35 1 0 0 0 0 33 36 1 0 0 0 0 36 37 2 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 5 6 1 0 0 0 0 8 9 1 0 0 0 0 31 32 2 0 0 0 0 34 35 1 0 0 0 0 31 35 1 0 0 0 0 M CHG 4 12 1 14 -1 38 1 40 -1 M END