IFLAB-ZINC04140236 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 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 0.6220 -0.6940 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6460 -2.0860 1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -2.7360 2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -2.0110 3.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7950 -0.6880 3.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -0.0350 2.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 0.0320 4.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -0.8650 5.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 -0.0430 6.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5410 0.9670 5.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 1.8570 4.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 0.9800 3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 -4.1210 2.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.8560 -0.0600 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6600 -3.1580 -1.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -3.1880 0.0260 O 0 5 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 -0.4180 -0.4910 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2390 -1.5750 5.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 -1.4060 4.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 0.4880 6.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9640 -0.7080 6.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8780 1.5830 6.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 0.4350 5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0770 2.4180 5.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 2.5500 4.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 0.4300 3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9080 1.6100 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -4.6430 1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -4.5680 2.8700 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 22 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 16 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 33 1 0 0 0 0 15 34 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