PUBCHEM-ZINC06545594 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 1 0 0 0 0 0999 V2000 0.2500 1.7290 -1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 2.0290 -2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 2.1830 -2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 2.4910 -3.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 2.5820 -4.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 2.4200 -4.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 2.1630 -3.7120 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.4370 2.9220 -5.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 2.6870 -6.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 4.0110 -7.7290 P 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 4.6020 -6.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 2.7100 -2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1270 3.9980 -1.4000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8190 3.3730 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2830 5.4890 -1.7780 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6810 6.1140 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9070 5.8210 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6510 5.8900 -1.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8930 5.5630 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5680 3.8610 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8940 3.0260 0.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 2.0750 -0.9160 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0300 0.7850 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 1.6330 -1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 2.5360 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 2.5040 -5.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3180 2.2730 -5.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 3.9620 -5.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0070 3.2570 -3.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0220 1.7470 -2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4900 5.2190 -3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1380 6.8690 -3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8420 5.6630 -3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 2.0820 -3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 3.4160 -8.9630 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.4410 4.8550 -7.9840 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.7320 3.5090 -1.6870 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4040 2.8700 -0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 4.2370 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5440 4.6010 0.4340 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 13 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 37 38 1 0 0 0 0 37 39 1 0 0 0 0 M CHG 1 7 1 M CHG 1 22 -1 M CHG 1 35 -1 M CHG 1 36 -1 M CHG 1 37 1 M CHG 1 40 -1 M END