PUBCHEM-ZINC02167654 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.9920 2.0490 1.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 1.7720 0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 0.5480 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -0.6900 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -1.8120 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0660 -1.6990 -0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 -0.4640 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9570 0.6640 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5810 1.9160 -0.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8740 2.5600 -1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 2.0090 -2.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 3.8150 -1.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 4.4500 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0760 5.7510 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2800 6.3820 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 7.6680 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 8.3270 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8810 7.7020 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3730 6.4180 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1450 -0.3420 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6800 -1.7060 -1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 2.9340 2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 2.2190 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 1.1920 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 2.6280 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 1.6020 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -0.7810 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.7790 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 -2.5780 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 2.3210 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5740 4.2780 -2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 3.9870 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0460 5.8680 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9420 8.1600 2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4760 9.3330 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 8.2190 -2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 5.9310 -2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6980 0.0000 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2680 0.3760 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7260 -1.6090 -1.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0990 -2.0680 -2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5980 -2.4130 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 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 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 M END