CHEMBRIDGE-ZINC00208901 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -1.1140 -2.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0180 -0.2310 -1.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9220 -0.7250 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -0.5010 2.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -1.2360 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 -1.4630 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1840 -1.9400 2.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8990 -2.1940 1.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 -1.9710 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -1.4880 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2850 -2.7060 1.5570 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.7930 -2.9040 2.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9170 -2.9310 0.5400 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 0.2680 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 -0.5440 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -1.2660 3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6380 -2.1170 3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8880 -2.1710 -0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -1.3110 -0.8260 H 0 0 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 7 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END