NCI:649562 BBtclserve11129920042D 0 0.00000 0.00000226370 999-99-9 36 38 0 0 0 0 0 0 0 0 2 V2000 2.6097 3.6348 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.4758 3.1348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3418 3.6348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2078 3.1348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2078 2.1348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3418 1.6348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4758 2.1348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0738 1.6348 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9399 2.1348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9399 3.1348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0739 3.6348 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8059 3.6348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8059 1.6348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6719 2.1348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6719 3.1348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5379 1.6348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5379 0.6348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4040 2.1348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2700 1.6348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6341 0.6496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4014 0.0083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6951 0.3058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9278 0.9471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5234 -0.6794 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4126 -2.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4736 -2.3522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7063 -1.7109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8781 -0.7258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8171 -0.3819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5844 -1.0232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1799 -2.6496 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0082 -3.6348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1189 -2.3058 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7673 -2.0547 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5956 -3.0399 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 2 7 2 0 0 0 0 5 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 4 11 1 0 0 0 0 10 12 1 0 0 0 0 9 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 13 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 24 30 1 0 0 0 0 25 31 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 27 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 6 7 1 0 0 0 0 10 11 2 0 0 0 0 29 30 2 0 0 0 0 25 30 1 0 0 0 0 M CHG 4 31 1 33 -1 34 1 36 -1 M END