PUBCHEM-ZINC05734653 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.1690 2.5330 1.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 1.0440 0.7760 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1680 0.8580 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 0.2560 1.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -0.3140 2.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 0.2550 1.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -0.5120 2.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 -0.4670 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 0.3400 1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1030 0.3600 1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4410 1.3560 0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 1.8780 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 1.2730 0.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 2.9150 -0.7820 N 0 3 0 0 0 0 0 0 0 0 0 0 5.8940 3.4730 -1.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 3.1720 -0.9700 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8240 -0.8200 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2550 -1.3730 0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 0.9480 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 1.4350 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6180 -1.0040 -0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 2.8000 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 3.1680 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 2.7920 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 0.8040 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4110 -1.1410 3.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7880 -0.2680 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4280 1.6560 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -1.4890 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -0.8780 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3130 -2.3780 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -1.3990 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 0.9970 1.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7420 1.5450 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 1.4890 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 2.4540 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9540 -0.9860 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6270 -2.0230 -0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2410 -0.3570 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 0.5730 0.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2100 -0.4940 -0.4440 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9220 -0.5230 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 40 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 27 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 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 17 40 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 19 41 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 20 40 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 41 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M CHG 1 41 1 M END