IFLAB-ZINC00150433 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2040 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0340 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4290 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -0.6840 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8930 -0.0950 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9930 -0.9630 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6230 -2.3070 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 -2.4310 -0.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5750 -3.2620 -0.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8410 -2.9660 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2750 -1.6790 -0.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3930 -0.6610 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7800 0.4950 -0.0670 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7130 -1.3970 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1930 -1.2940 -1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4120 -1.4430 -2.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4920 -1.0380 -1.7720 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9270 -0.9450 -3.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9880 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0060 0.9790 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5670 -3.7650 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9020 -0.4560 0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2450 -2.2020 0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1160 -0.9190 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9170 -0.7500 -3.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7050 -1.7820 -3.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 M END