CHEMBRIDGE-ZINC04947688 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 0 0 0 0 0 0999 V2000 0.0030 1.5040 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -0.0030 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.6490 1.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.0460 2.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -0.7860 3.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -1.9990 3.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.1800 4.4940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.9460 5.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -2.1930 5.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -2.9460 6.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -2.4600 7.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -1.2190 7.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -0.4580 6.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -3.2700 9.2080 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2420 -4.3630 9.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -2.8430 10.1730 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0080 -0.7500 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 1.8730 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 1.8680 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 1.8590 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 0.7860 4.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -2.5730 4.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -3.9150 6.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -0.8420 8.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 0.5120 6.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -0.9230 -1.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -1.7060 -1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 -0.1600 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 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 13 2 0 0 0 0 9 10 2 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END