IFLAB-ZINC02716166 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 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 1.3170 -0.7400 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -1.6760 1.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -3.0110 0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -3.9420 0.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -5.0580 0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -1.2240 2.5320 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 -2.4250 3.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -0.1880 2.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -0.4880 3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -1.2720 4.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -0.6990 5.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 0.6680 5.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 1.4530 4.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 0.8740 3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 1.2510 5.9170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 -1.2910 -0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.0240 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -3.3860 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -2.9560 0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -3.6890 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 -5.7250 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -5.3110 1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -2.3350 4.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -1.3120 5.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 2.5160 4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 1.4840 2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 0.7020 6.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 2.2060 5.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 25 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 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 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 M END