IFLAB-ZINC04338825 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.5700 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -2.5570 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -2.5260 2.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8480 -2.6390 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 -3.1040 3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1710 -3.5320 4.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -3.8590 5.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3720 -3.6660 4.6700 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9490 -3.1990 3.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 -2.8470 2.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 -2.4190 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 -2.3180 1.3200 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7630 -3.9230 5.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -3.6600 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -2.2190 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -2.2420 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3750 -2.2320 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 -3.6830 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -3.6470 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -2.1960 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -2.1800 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 -2.7680 3.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -3.5800 5.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3880 -2.1420 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0250 -4.9510 4.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4200 -3.2400 4.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8790 -3.7680 6.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 21 2 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 M END