PUBCHEM-ZINC04537113 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 1 0 0 0 0 0999 V2000 -0.1890 1.1330 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 -0.1310 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -0.4630 -0.0310 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 0.5380 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 0.2450 -0.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 1.8560 0.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 2.1520 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 3.4680 0.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -1.8780 -0.1390 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9950 -2.4760 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 -2.3890 -1.4560 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8200 -2.5740 -2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 -3.6690 -0.8950 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3250 -4.3500 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -3.1410 0.3910 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6640 -2.5440 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -2.2680 0.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1980 -4.3100 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1430 -5.0910 0.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -5.7460 -0.8910 P 0 0 0 0 0 0 0 0 0 0 0 0 3.4450 -6.6130 -0.6110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 -4.3750 -1.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -1.5410 -2.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 -0.9250 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 1.4220 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -0.9390 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 3.7990 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 4.1480 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 -3.9510 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -4.9320 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8560 -6.2810 -1.6250 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 7 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 20 31 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 31 -1 M END