IFLAB-ZINC02712586 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 0 0 0 0 0 0999 V2000 -0.1260 1.6170 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 0.5750 0.1790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 -0.0740 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 0.2880 -2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -0.3670 -3.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -1.3970 -2.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9350 -1.7610 -1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3110 -1.0970 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -1.4450 0.7190 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 -2.5020 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 -2.1000 -4.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 -2.9970 -3.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 -1.7480 -5.3150 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 -2.3590 -6.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -1.6290 -7.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3180 -2.2420 -8.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -3.5260 -8.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2580 -4.2480 -7.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -4.5380 -6.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -3.7080 -6.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 -4.4570 -5.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 -4.2920 -9.7130 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3240 -5.9740 -9.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9490 -6.8360 -10.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7230 -7.8370 -10.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -0.2840 -6.8890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 2.3880 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 1.2060 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 2.0510 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 1.0840 -2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 -0.0840 -4.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -2.5580 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 -3.4110 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 -2.2240 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -2.6790 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -1.0740 -5.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5560 -6.3860 -8.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2430 -5.9510 -9.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7580 -6.6280 -11.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9140 -8.0450 -9.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1710 -8.4540 -11.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 0.1560 -6.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5290 0.2160 -7.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 20 2 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M END