PUBCHEM-ZINC04655721 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 69 0 0 1 0 0 0 0 0999 V2000 0.1990 1.7890 -0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 0.3220 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 0.0670 0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5930 -1.9750 -1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -2.4970 -2.7550 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1530 -2.4630 -2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -3.9090 -3.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -4.2570 -4.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -5.5770 -4.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -6.5370 -4.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -7.8590 -4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -8.2280 -5.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 -7.2730 -6.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8610 -5.9380 -5.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7360 -4.9530 -6.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -4.3900 -7.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 -3.4440 -8.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 -3.0580 -7.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 -3.6090 -6.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9610 -4.5450 -5.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 -5.1390 -4.6850 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 -4.5350 -3.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 -5.1730 -2.5180 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2040 -5.0500 -2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2500 -4.6170 -1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4980 -5.5130 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4950 -6.7510 1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4410 -4.2360 1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4510 -6.5920 -2.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9300 -6.9120 -3.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -1.5710 -3.7410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -2.0070 -4.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 2.1160 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 1.9650 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 2.4240 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 0.0160 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 0.2950 0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 0.6900 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -0.9770 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -2.1330 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -2.4010 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -4.5930 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -3.9200 -3.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -6.2880 -3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -8.6030 -4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -9.2570 -5.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 -7.5750 -7.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -4.6850 -8.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8170 -3.0150 -9.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9760 -2.3300 -8.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7260 -3.2990 -6.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2890 -4.7600 -4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 -3.4520 -3.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 -4.6040 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 -3.6280 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3860 -5.5220 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5970 -6.7970 2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5340 -7.6660 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3670 -6.7530 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2870 -4.1910 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4930 -3.3460 0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5190 -4.1790 1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -0.4880 -1.4260 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4950 -0.2280 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -0.2680 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3020 -5.5860 -0.3930 N 0 3 0 0 0 0 0 0 0 0 0 0 5.4320 -5.5490 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2680 -6.5120 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 63 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 4 63 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 31 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 12 13 2 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 14 15 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 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 18 19 2 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 29 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 66 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 56 1 0 0 0 0 26 66 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 60 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 63 64 1 0 0 0 0 63 65 1 0 0 0 0 66 67 1 0 0 0 0 66 68 1 0 0 0 0 M CHG 1 63 1 M CHG 1 66 1 M END