PUBCHEM-ZINC05999594 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7920 1.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.5280 2.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -1.5620 3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.8770 2.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -3.1620 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.1240 0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.0630 -0.7190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.8180 -1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7480 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.2280 -2.4800 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3910 0.7770 -2.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -0.1890 -2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 0.4440 -4.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 -0.3420 -5.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 0.2390 -6.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 1.6060 -6.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 2.3920 -5.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 1.8110 -4.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -1.1110 -3.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -2.0390 -3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -0.6340 -4.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 0.5290 -4.7890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -1.5260 -5.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6700 -1.0350 -6.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -1.8720 -7.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -3.1950 -6.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -3.6880 -5.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 -2.8600 -4.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 0.4920 2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -1.3530 4.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -3.6840 3.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -4.1880 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -1.2040 -3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 0.3960 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -1.4100 -5.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -0.3750 -7.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 2.0600 -7.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 3.4600 -5.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 2.4240 -3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 -0.0020 -6.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8530 -1.4930 -8.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 -3.8460 -7.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -4.7220 -5.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -3.2450 -4.0730 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 11 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 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 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 M CHG 1 2 1 M END