NIH-ZINC04041202 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 1 0 0 0 0 0999 V2000 0.2020 2.0030 0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 0.6540 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -0.1330 0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 0.5010 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 1.8340 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 2.6120 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 2.0540 -0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6570 0.8570 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7170 -0.0850 0.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0530 0.5890 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8580 1.7170 -0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5450 -0.6530 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -0.8620 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2600 -2.3210 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3730 -2.8030 0.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0260 -2.9330 0.0270 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8960 -2.0160 -0.1830 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2120 -2.1500 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2180 -2.2940 -1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 -2.5740 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 -2.8410 -2.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 -2.8320 -3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4130 -2.5490 -3.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0040 -2.2840 -2.6240 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 -4.3570 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5340 -4.6570 1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3950 -6.1560 1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4120 -7.9540 3.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2090 -8.2420 5.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9030 -7.8390 5.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7100 -6.4340 5.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 -6.0440 3.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8410 0.0250 -0.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 2.5930 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 0.2130 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2570 -1.1790 1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 3.6620 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 2.9850 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 -2.5790 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -3.0510 -2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 -3.0390 -4.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 -2.5300 -4.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 -4.7250 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7800 -4.8660 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3280 -4.2540 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6100 -4.1380 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5490 -6.5790 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3150 -6.6660 1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4310 -8.2020 3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6830 -8.4970 3.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3010 -9.3170 5.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9640 -7.7340 5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 -6.1880 5.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 -5.8860 6.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0780 -6.5590 3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -4.9620 3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7970 1.4270 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1940 -6.4690 3.3890 N 0 3 0 0 0 0 0 0 0 0 0 0 6.9130 -5.9560 3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 11 57 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 33 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 32 58 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END