PUBCHEM-ZINC06467979 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 26 0 0 1 0 0 0 0 0999 V2000 0.1900 2.1890 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 0.6660 -0.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8570 0.3300 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 0.0340 -1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 0.3310 -2.9550 P 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 1.6990 -3.5580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -0.6860 -4.2360 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4300 -1.3620 -3.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -1.3900 -5.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -1.6370 -6.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -0.6670 -6.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -0.2070 -2.8050 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0150 0.2370 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 0.4850 0.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 2.5780 -0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 2.5580 -0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 2.6190 0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 0.3880 -1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 -1.0520 -1.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -2.3270 -4.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 -0.7730 -5.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -2.7290 -7.1400 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5030 0.3910 -4.9540 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4610 0.1950 -6.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 0.4910 -4.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 1.2700 -4.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -0.3080 1.9630 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 12 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 20 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 M CHG 1 12 -1 M CHG 1 22 -1 M CHG 1 23 1 M CHG 1 27 -1 M END