PUBCHEM-ZINC05159879 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 -0.7780 1.1100 -2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -0.3580 -2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -1.1150 -3.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -0.8310 -1.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -2.1850 -0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 -3.0880 -0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -4.4360 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -4.8880 -0.6840 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8810 -4.0730 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -2.6860 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6810 -1.8380 -1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9170 -2.3590 -1.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 -3.7230 -1.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1700 -4.5720 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -6.2730 -0.5440 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2810 -0.0710 -0.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 0.1210 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 -0.3750 0.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 0.9530 1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 1.3000 -2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 1.6870 -1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 1.4060 -3.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -2.7450 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -5.1310 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -0.7790 -1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 -1.7050 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 -4.1120 -1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 -5.6280 -1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 1.3110 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 1.8040 1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 0.3450 2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 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 16 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 M CHG 1 8 1 M CHG 1 15 -1 M END