PUBCHEM-ZINC03872649 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.5150 1.4220 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 -0.0320 -0.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -0.8010 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -1.0940 1.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9120 -0.7130 1.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7970 -1.1130 2.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0820 -1.7720 3.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7410 -1.8100 3.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -2.4850 3.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -3.0120 5.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7950 -2.8960 5.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 -2.2880 4.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 -3.4610 6.4090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -2.6660 3.7580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -0.6300 -1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 0.1130 -2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -0.4810 -3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -1.8510 -4.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -2.6140 -2.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 -2.0050 -1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4930 -2.4650 -5.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -1.8480 -6.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -3.7030 -5.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -4.5820 -6.5800 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1360 -3.9690 -7.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -5.5960 -6.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 -4.9490 -6.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -5.9190 -6.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 -7.1310 -6.4800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 -5.4270 -6.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -5.5290 -5.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 1.8660 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 1.8500 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 1.7290 0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -1.7370 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 -0.2430 1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -0.1640 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6390 -3.9240 7.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2730 -3.3910 6.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -2.3620 2.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -3.1430 4.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 1.1810 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 0.1300 -4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -3.6790 -2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -2.6440 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -4.1030 -4.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -6.3100 -7.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -6.1860 -5.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5600 -4.2710 -5.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -4.3510 -7.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 -5.3740 -6.9880 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8810 -5.8770 -7.6340 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 M CHG 1 51 -1 M CHG 1 52 -1 M END