IFLAB-ZINC04315240 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 0.1080 2.8830 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 1.5210 -0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 0.6670 -0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 1.1640 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 2.5430 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 3.3960 -0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 2.7240 -0.6990 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 3.5670 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 1.4990 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4580 0.5870 -0.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 1.2380 -0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2600 1.4530 1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7690 1.2460 1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1490 1.9760 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6510 2.2050 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9320 2.1190 0.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2930 2.8550 1.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7290 2.1710 3.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3360 3.1780 4.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6720 4.5240 3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7110 4.1760 1.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 3.5450 -1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 1.1330 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -0.3910 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 4.4570 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 0.2110 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.4670 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7310 0.7380 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0590 1.4120 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 0.2260 0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4040 0.9530 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7160 2.6730 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 2.0270 -2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3980 3.2310 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4500 2.5820 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2330 1.0740 0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3760 2.9210 2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2670 3.1120 4.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9040 3.0690 4.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8920 5.2600 3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6430 4.8930 3.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4810 2.1940 0.4120 N 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 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 15 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 14 42 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 M END