NIH-ZINC00253382 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.0210 1.3310 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0060 -0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -0.6390 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 0.0160 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 -0.6250 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -1.9240 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5190 -2.5840 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -1.9410 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 -3.8580 0.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -4.4710 1.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 -2.5740 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 -1.8580 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 -0.6420 0.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3260 -2.5440 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5240 -1.8170 0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6730 -2.4510 0.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7340 -3.7820 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9880 -4.4060 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0560 -5.7650 0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8760 -6.5180 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6780 -5.9000 0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6000 -4.5440 0.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3900 -3.9550 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3730 -4.6250 0.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 1.7180 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 1.3380 -1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 1.9590 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 1.0280 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4450 -0.1130 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -2.4520 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -5.4830 1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -4.5100 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -3.8890 2.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 -3.5400 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5050 -0.7400 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8900 -3.8130 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0140 -6.2560 0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9220 -7.5950 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7720 -6.4880 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 M END