PUBCHEM-ZINC06364760 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 26 0 0 1 0 0 0 0 0999 V2000 -1.1570 1.1930 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6450 -0.1140 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -0.5350 0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -1.1280 0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -1.7100 -1.1940 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -0.6310 -1.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -2.7770 -0.4200 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4900 -3.2930 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7420 -2.4490 -0.9160 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9500 -2.3240 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8980 -3.1510 -1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2900 -2.4480 -2.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 2.0060 0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 1.4720 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 1.0940 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 0.0060 -1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -0.6960 1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -1.4860 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4470 0.2170 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2380 -3.3520 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 -4.3200 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -2.4550 -2.1100 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.2940 -4.2520 -1.2060 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.5740 -1.0570 -1.4770 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.0860 -1.0980 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5370 -0.7720 -1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9880 -0.3250 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 M CHG 1 22 -1 M CHG 1 23 -1 M CHG 1 24 1 M END