MAYBRIDGE-ZINC03119619 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4440 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -0.5150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 0.7580 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 1.9860 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 3.4430 0.0060 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4430 4.2920 0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 3.8900 -0.0030 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.1430 -0.7980 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -2.1360 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0930 -2.8700 0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9830 -4.2090 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 -5.0020 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 -6.4500 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3150 -6.9920 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5680 -5.7640 0.0270 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -4.4910 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 -8.4490 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.5690 -9.2980 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8140 -8.8970 0.0120 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9280 2.0250 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -1.5650 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 -0.3360 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -4.6700 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -7.0310 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6860 -3.4410 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 17 26 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 6 1 M CHG 1 8 -1 M CHG 1 18 1 M CHG 1 20 -1 M END