PUBCHEM-ZINC02047626 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.2400 0.8790 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 1.3600 -1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 1.7570 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 2.1980 -2.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 2.2270 -3.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 1.8380 -3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1570 1.4190 -2.4520 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3710 2.7590 -5.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 4.1620 -4.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 5.0110 -6.3130 P 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 4.6940 -6.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 2.6370 -2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 4.1710 -1.6190 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.6110 3.4400 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0490 5.5430 -2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4620 5.5340 -3.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7380 6.7980 -4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5760 4.3340 -0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7930 3.9600 0.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 1.7460 -0.3310 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7510 -0.0060 0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 0.5990 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 1.6670 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 1.8640 -4.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 2.4580 -5.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3570 2.3740 -5.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 3.0960 -3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 1.7670 -2.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0950 5.8690 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5270 6.2970 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3780 5.3970 -3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8780 4.6820 -4.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8030 6.8970 -4.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3870 7.7010 -4.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 1.1450 -2.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 6.4740 -5.8430 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8420 4.6070 -7.4030 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.5730 3.6240 -1.6460 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4030 3.0990 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 4.3600 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0240 6.7040 -5.8010 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.9190 6.8170 -5.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2840 7.2960 -6.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9200 5.6700 -6.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7490 4.7950 -0.1220 O 0 5 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 20 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 24 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 18 1 0 0 0 0 13 38 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 41 42 1 0 0 0 0 41 43 1 0 0 0 0 41 44 1 0 0 0 0 M CHG 1 7 1 M CHG 1 20 -1 M CHG 1 36 -1 M CHG 1 37 -1 M CHG 1 38 1 M CHG 1 41 1 M CHG 1 45 -1 M END