NIH-ZINC04093580 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 0.5180 -4.6840 1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -3.7660 0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -2.3920 0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -1.5780 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -2.0900 -1.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -3.3950 -1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -4.2740 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -3.8930 -2.8760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -3.0430 -3.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -1.8470 -3.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -3.5790 -5.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -2.4140 -6.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -2.9500 -7.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -4.1460 -7.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -2.1020 -8.7220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -0.6550 -8.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -0.1360 -8.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 0.1690 -9.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 0.6460 -10.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4890 0.8180 -8.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 0.5120 -7.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 0.0400 -7.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7510 1.2830 -9.0490 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.6360 -2.6260 -10.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -2.8140 -10.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 -2.5370 -9.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -3.2890 -11.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -3.4720 -11.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -4.0190 -13.3790 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4640 -3.3770 -14.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4820 -4.1380 -13.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5440 -5.4340 -14.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -5.9440 -14.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 -5.3680 -13.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -4.8260 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -5.6470 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -4.2430 2.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -1.9640 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.5090 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -5.3380 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -4.8500 -3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -4.2340 -5.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -4.1420 -5.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -1.7600 -6.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -1.8520 -6.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -0.1660 -9.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -0.4440 -7.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7800 0.0350 -10.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 0.8840 -11.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 0.6460 -6.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -0.1940 -6.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -1.9230 -10.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -3.5850 -10.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -3.5110 -12.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3130 -4.1750 -11.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3800 -2.5130 -11.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1090 -4.2280 -12.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 -3.2800 -14.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2010 -6.1640 -14.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8790 -5.2160 -15.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0640 -7.0320 -14.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -5.5980 -15.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 34 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 33 34 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 M END