NIH-ZINC04039871 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 65 0 0 1 0 0 0 0 0999 V2000 -0.0510 2.7880 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 1.5360 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 0.3920 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -0.5320 1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 0.0090 0.3140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 -0.4410 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 1.2560 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 2.0400 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 3.1500 -1.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 1.3410 -1.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2170 2.0130 -3.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 -1.8980 1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 0.2850 3.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -0.7280 4.3890 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3500 -0.1780 5.5160 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9260 -1.0320 5.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 0.1620 6.6370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -0.3780 6.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -0.3480 7.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -1.0950 5.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 -1.8660 4.8430 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 0.8890 7.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -0.0450 8.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -0.1580 10.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9030 1.3850 10.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 0.8880 5.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 0.5380 4.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 1.5030 4.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 2.8330 4.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9030 3.1940 4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 2.2290 4.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 3.6730 3.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8660 4.9980 3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 1.0690 3.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 2.6040 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 3.6050 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 3.1450 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 2.9530 -2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 2.1910 -3.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 1.3670 -3.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7610 -1.8680 2.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8210 -2.3410 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 -2.5640 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 1.3830 8.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 1.6730 7.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -0.6010 8.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -0.7630 9.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -0.9710 11.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 -0.5450 10.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 0.4540 11.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 2.1320 10.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 0.6180 11.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 1.8810 11.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 -0.4900 4.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6450 1.2130 4.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 4.2150 4.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 2.5420 5.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4900 5.5500 4.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 4.9980 2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7650 5.5120 3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 -1.6500 3.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 0.7240 10.1040 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6030 1.4690 9.7530 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 13 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 34 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 61 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 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 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 62 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 62 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 62 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 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 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END