IFLAB-ZINC02457397 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 0.4810 1.6810 -1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 0.2080 -1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -0.2190 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -1.5680 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -2.4970 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 -2.0650 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -0.7140 -2.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -0.2440 -4.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -3.8630 -0.8130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -4.5660 -1.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -6.0180 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -6.6180 -1.2190 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -5.8990 -0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -4.4510 -1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -7.7940 -1.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0720 -8.3230 -2.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -8.4430 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -9.0890 -3.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 -9.6930 -3.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 -9.6580 -2.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -9.0130 -1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -8.4140 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9570 -10.3060 -3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0880 -10.8680 -4.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 -2.0320 1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 1.9950 -1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 1.8730 -2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 2.2410 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 0.5040 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -2.7850 -3.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 -0.1730 -4.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -0.9540 -4.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 0.7350 -4.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -4.5490 -2.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -4.0740 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -6.5750 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -6.0420 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 -6.3760 -1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -5.9110 0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -3.8750 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 -4.4350 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 -9.1150 -4.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -10.1920 -4.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -8.9860 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 -7.9180 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -2.1030 1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -3.0110 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -1.3190 2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9820 -10.2730 -2.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8020 -10.7100 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 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 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 49 50 1 0 0 0 0 M END