PUBCHEM-ZINC05453244 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 62 0 0 0 0 0 0 0 0999 V2000 0.1420 -0.4280 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 0.3430 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -1.6530 1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5590 -1.6880 2.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -0.1650 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 1.2870 1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 1.3910 1.5330 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2870 1.7640 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 3.2650 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8330 3.9550 0.9920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7620 3.8400 -1.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7520 5.2990 -1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 5.6720 -2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7330 7.1950 -2.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9820 7.7780 -2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9910 7.4050 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 5.8810 -0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 1.1440 2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 0.7430 3.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9760 1.3620 2.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4640 2.5340 1.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8250 2.7310 1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7060 1.7690 2.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2280 0.6050 2.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8700 0.3990 2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1650 1.9870 2.1160 N 0 3 0 0 0 0 0 0 0 0 0 0 10.5880 3.0100 1.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9420 1.1420 2.5230 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1670 -1.4690 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 0.0150 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -0.3800 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 1.3830 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 0.2990 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -2.1060 2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 -2.2070 0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -1.1340 2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -1.2340 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8780 -2.7230 2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1530 -0.5000 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -0.7960 2.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 1.9240 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 1.6060 2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3120 1.4000 0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 1.3200 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 3.2880 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8620 5.7030 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 5.2680 -3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 5.2570 -3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 7.4610 -3.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 7.5990 -2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8720 7.3740 -2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 8.8630 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8800 7.8200 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 7.8090 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0070 5.6150 0.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8910 5.4770 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7780 3.2850 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2040 3.6370 1.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9210 -0.1420 3.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4980 -0.5080 3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -0.2590 1.5580 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 61 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 61 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 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 45 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 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 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 49 1 0 0 0 0 14 50 1 0 0 0 0 15 16 1 0 0 0 0 15 51 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 53 1 0 0 0 0 16 54 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 19 2 0 0 0 0 18 20 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 57 1 0 0 0 0 22 23 1 0 0 0 0 22 58 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 59 1 0 0 0 0 25 60 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END