PUBCHEM-ZINC04097101 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 -0.0890 1.4130 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 -0.0040 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -0.3120 -1.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -0.9070 0.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -2.3710 0.2250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3490 -2.7380 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7890 -2.7910 -0.6070 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6740 -2.2240 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -4.3020 -0.4960 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2820 -4.8470 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -4.7650 0.9630 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9270 -4.2860 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 -4.3930 1.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -2.9910 1.6350 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5090 -2.5350 2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -2.7360 2.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -6.2850 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 -6.6360 2.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 -8.2360 2.8050 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 -8.9270 1.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -4.5710 -1.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2170 -4.1190 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 -2.5370 -2.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -1.6360 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 1.9680 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 1.8810 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 1.4430 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -0.5810 1.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -3.4430 3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 -6.6230 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -6.7920 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -8.5290 2.6010 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.8630 -8.3180 4.2540 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 32 -1 M CHG 1 33 -1 M END