NCI:657779 BBtclserve11129920072D 0 0.00000 0.00000229669 999-99-9 40 43 0 0 0 0 0 0 0 0 2 V2000 15.9844 3.9838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0333 4.2928 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 14.4456 3.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0333 2.6747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9844 2.9838 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.9354 4.2928 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.3423 5.2438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4456 3.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9456 2.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9456 2.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4456 3.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9455 4.3498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9455 4.3498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9456 2.6177 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9456 2.6177 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4456 3.4837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7431 -3.6611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -2.6830 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9456 -2.5785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3523 -3.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6092 -4.1611 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.3303 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2819 -1.9399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4456 0.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4456 0.0196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9456 -0.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4456 -1.7124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4456 -1.7124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9456 -0.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9456 0.8856 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4456 1.7517 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9456 0.8856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4456 1.7517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9456 0.8857 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.5232 3.4838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9355 2.6747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 -5.2438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 -5.1393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5232 0.0000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 14.2243 4.8806 0.0000 Cl 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 2 7 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 3 11 1 0 0 0 0 11 12 1 0 0 0 0 8 13 1 0 0 0 0 14 15 1 0 0 0 0 8 16 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 17 21 1 0 0 0 0 17 22 1 0 0 0 0 18 23 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 19 27 1 0 0 0 0 27 28 2 0 0 0 0 24 29 2 0 0 0 0 30 31 1 0 0 0 0 24 32 1 0 0 0 0 15 33 1 0 0 0 0 33 34 2 0 0 0 0 6 35 1 0 0 0 0 5 36 1 0 0 0 0 22 37 1 0 0 0 0 21 38 1 0 0 0 0 4 5 1 0 0 0 0 10 11 2 0 0 0 0 12 13 2 0 0 0 0 14 16 2 0 0 0 0 20 21 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 30 32 2 0 0 0 0 31 33 1 0 0 0 0 35 36 2 0 0 0 0 37 38 2 0 0 0 0 M CHG 3 2 1 18 1 40 -1 M END