PUBCHEM-ZINC04531661 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3420 0.0090 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 1.3180 -0.3820 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -1.2920 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 0.7470 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 1.7750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -0.9190 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -1.1210 -1.4240 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8880 -0.1510 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -1.9350 -1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0040 -2.9960 -1.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -1.8280 -2.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -1.6890 -3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -0.9790 -4.1030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 -2.4160 -4.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -2.0890 -5.8220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2800 -1.0080 -5.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -2.7160 -6.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -3.7530 -7.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 1.9650 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 0.7930 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -1.8820 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -0.4730 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -2.3960 -1.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -2.1000 -4.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -3.4900 -4.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -2.3620 -7.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0390 -1.4800 -0.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -2.1220 -6.6450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -2.6200 -6.2970 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -3.6210 -6.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 -2.5610 -7.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 -2.0370 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 30 1 0 0 0 0 18 19 2 0 0 0 0 18 29 1 0 0 0 0 27 30 1 0 0 0 0 28 33 1 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 M END