PUBCHEM-ZINC03874454 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 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 0 0 0 0 0 0 0 0 0 0 0 -1.1870 -0.7120 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1870 -2.1180 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -2.7810 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5430 -2.0620 0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4950 -0.7470 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -0.0790 0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -4.1220 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -4.2470 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -3.0700 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 -5.2190 0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9860 -4.9480 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -5.5710 1.4520 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4630 -5.0970 1.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 -7.1080 1.4370 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6860 -7.3950 1.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -7.5040 -0.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2430 -7.5860 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 -6.4240 -0.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 -8.8240 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3600 -9.2300 -1.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -10.5790 -1.8100 P 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -11.7350 -1.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -7.7110 2.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 -5.1740 2.3700 O 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 0.8490 -0.4780 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4220 -0.1930 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -5.1850 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -8.6890 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1250 -9.5890 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 -7.4490 3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -5.3710 3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -10.7850 -3.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -10.4650 -1.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -9.7280 -1.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -11.5810 -3.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 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 11 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 25 35 1 0 0 0 0 26 36 1 0 0 0 0 37 40 1 0 0 0 0 38 39 1 0 0 0 0 M END