IFLAB-ZINC04482955 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 2.3430 1.6100 -0.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0160 0.1480 -0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -0.4880 0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -1.8610 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -2.6310 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -1.9890 -1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -0.6160 -1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -4.0830 -0.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -4.7210 -1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -6.1740 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -6.9200 -2.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 -6.3900 -3.3420 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3510 -5.4000 -3.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -7.3350 -3.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -7.2370 -3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 -8.0080 -3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 -8.7400 -4.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -6.2760 -4.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -7.3180 -5.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -6.8080 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -8.1740 0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -8.7700 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -7.9870 2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -6.6240 2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -6.0370 0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7270 -4.6960 0.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -10.2410 1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4240 1.7550 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0560 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 2.1490 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 0.0780 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -2.3240 1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -2.5510 -2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -0.1510 -2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -4.2010 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -7.0880 -4.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -8.3740 -3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0830 -7.5930 -2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -6.1840 -2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -8.7780 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -8.4340 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -6.0220 2.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -10.7960 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -10.4690 2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -10.5880 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5590 -7.8080 -2.9030 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7850 -5.1170 -4.4520 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M CHG 1 46 -1 M CHG 1 47 -1 M END