PUBCHEM-ZINC05733108 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.1050 1.6700 0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 0.1820 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -0.4850 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -0.4940 -0.1650 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9390 -0.1860 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 -0.0070 -1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4080 -0.4650 -1.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -1.9900 -0.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -2.6660 0.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 -3.9990 0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -4.7780 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -6.0040 -0.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -4.0440 -1.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -4.5540 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -2.6700 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -2.1480 -2.0800 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 -4.6640 2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1560 -5.1830 2.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 2.1410 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 2.2280 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 1.7950 1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 0.1200 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 -0.5030 2.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -1.5130 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 0.0580 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -2.0470 1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 0.7920 -2.1860 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 17 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 3 0 0 0 0 M CHG 1 27 -1 M END