NCI:137541 BBtclserve11129917442D 0 0.00000 0.00000103868 29781-51-9 27 28 0 0 0 0 0 0 0 0 2 V2000 3.9595 2.8866 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1674 3.8648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 2.2175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4243 4.5339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1185 4.1738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 2.4254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6811 5.2030 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.7551 3.7908 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.0934 5.2770 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.7230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5116 0.8162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0875 3.3389 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.5594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.2770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1753 1.4548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.2770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.2770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.7770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.7770 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 -5.2770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -5.2770 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 2 4 1 0 0 0 0 2 5 2 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 11 15 1 0 0 0 0 14 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 21 23 2 0 0 0 0 22 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 12 14 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 2 25 1 27 -1 M END