PUBCHEM-ZINC05694832 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -2.5210 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -4.0510 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -4.5230 -3.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 -4.7780 -3.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -4.6900 -3.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 -5.0250 -3.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0580 -5.4500 -4.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 -5.5430 -5.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -5.2080 -5.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -5.1960 -5.7950 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5820 -4.8000 -4.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -4.6770 -5.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -5.5750 -7.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9370 -7.0730 -7.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1110 -7.3090 -6.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -7.4450 -8.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -8.8160 -8.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -9.3100 -9.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -10.6340 -10.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -11.1360 -11.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -10.3150 -12.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -8.9910 -12.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -8.4880 -11.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -10.8090 -13.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -9.9080 -14.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0940 -7.8150 -6.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.1600 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -2.1440 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -4.4120 -1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -4.4280 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 -4.3590 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7010 -4.9560 -2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0510 -5.7100 -5.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1570 -5.8740 -6.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -4.3730 -4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -4.8950 -6.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -5.0120 -7.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1240 -5.3540 -7.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 -6.8160 -9.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 -7.2920 -9.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -11.2730 -9.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -12.1660 -11.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -8.3520 -13.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -7.4560 -10.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -9.0670 -14.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -9.5420 -14.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -10.4280 -15.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 -7.6540 -7.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 15 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 44 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 12 2 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 30 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 55 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 61 1 0 0 0 0 M CHG 1 14 1 M END