PUBCHEM-ZINC05631688 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 26 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.5850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 2.2970 -2.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 1.2320 -1.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 1.6890 -2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1020 2.4770 -3.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 1.3420 -2.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7520 1.8270 -3.9320 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4080 2.8330 -4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2560 1.8570 -3.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5460 2.8680 -2.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6390 3.5030 -2.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8130 3.0680 -2.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 0.9080 -5.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -0.0550 -4.9450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.4370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 0.6000 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 2.7730 -4.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 0.7740 -2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7900 2.1320 -4.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5840 0.8710 -3.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5380 2.5600 -2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0000 3.7180 -1.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0240 1.1570 -6.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8180 0.5390 -7.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 26 27 1 0 0 0 0 M END