PUBCHEM-ZINC05161568 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 30 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.8010 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.4980 2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -1.5110 3.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.8380 3.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -3.1590 1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1450 0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1370 -0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7880 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.4940 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -1.4620 -3.3880 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0050 -2.7390 -3.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -3.1240 -1.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -1.1090 -4.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 0.5330 2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -1.2690 4.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -3.6240 3.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -4.1940 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 0.5350 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -3.4930 -3.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -4.1700 -1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -1.0070 -5.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -1.8920 -5.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -0.1640 -4.9400 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 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 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 20 1 0 0 0 0 6 7 2 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 9 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 23 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 15 28 1 0 0 0 0 M CHG 1 12 1 M END