PUBCHEM-ZINC05115990 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 1 0 0 0 0 0999 V2000 0.8050 0.8490 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -0.4980 0.2030 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3690 -1.2120 -0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -0.6910 1.6930 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9160 -1.5240 2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -2.3610 0.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 -2.5690 1.1390 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1860 -2.5300 2.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -3.8890 0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -4.6140 1.8430 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9410 -5.6170 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -6.0660 3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0090 -5.3600 3.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -4.4950 2.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8180 -3.5280 2.0680 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.4050 -2.4520 1.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0020 -3.8310 2.2440 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.1820 -1.4420 0.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0940 -1.6180 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 0.4540 2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 1.2940 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 0.7620 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 1.5370 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -3.0670 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -2.4300 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8120 -3.7400 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2830 -4.5700 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -5.9340 2.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 -6.8600 4.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 1.2380 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 0.1040 3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 0.8980 2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -0.9760 0.6800 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3680 -0.2980 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 33 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 6 25 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 33 1 M END