MAYBRIDGE-ZINC03833811 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 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 0.5880 -0.3550 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 -0.5340 -0.1120 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0270 -0.1500 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -2.0640 -0.0600 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8500 -2.4500 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -2.5090 1.2380 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3070 -2.1650 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -1.9030 1.3000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2760 -2.2790 0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -0.4790 1.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -2.2770 2.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 -2.5110 2.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -2.4120 1.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 -2.8550 3.7710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -3.9340 1.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 -2.5650 -0.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -0.1060 -1.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 2.0200 0.0000 O 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 0.7860 -2.3560 3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -2.9340 4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 -3.0240 3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -4.2860 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -3.5290 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 -0.4060 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 2.9850 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 24 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 18 27 1 0 0 0 0 19 28 1 0 0 0 0 20 29 1 0 0 0 0 M END