PUBCHEM-ZINC01855675 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.3890 1.6200 -0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 0.1760 -0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 0.1650 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 0.7830 1.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 0.1550 1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3510 0.1770 0.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -0.4820 -0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -1.2720 2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -1.6160 3.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -2.9260 3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -3.8910 3.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -3.5470 2.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 -2.2370 2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 0.8980 2.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9320 0.9280 2.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 1.6100 3.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1130 2.2610 4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 2.2300 4.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 1.5450 4.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -0.6030 -1.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -0.0940 -1.3990 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7110 -0.6710 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7060 -0.4730 -2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 1.3700 -1.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 2.2570 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 1.6680 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 1.9640 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -0.8640 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 0.7180 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 -0.3910 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -1.5360 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -0.8620 3.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -3.1950 4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 -4.9140 3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -4.3010 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 -1.9670 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3980 0.4190 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7830 1.6340 3.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 2.7940 5.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 2.7390 5.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 1.5180 4.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -1.6600 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -0.4780 -2.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -1.7550 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -0.4110 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -0.2740 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -0.0450 -3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 -0.0960 -2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7220 -1.5590 -2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 1.6470 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9990 1.7590 -1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 1.7890 -2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 M CHG 1 21 1 M END