IFLAB-ZINC04317041 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4100 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 1.2950 -0.3760 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 0.7310 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -1.7950 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 -2.2480 -1.4090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -3.4940 -1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -4.2400 -0.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 -3.9590 -3.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 -5.6630 -3.1050 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 -5.9420 -4.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -7.1930 -5.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -7.3840 -6.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 -6.3600 -7.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4140 -6.4860 -8.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9620 -5.1840 -7.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -4.2880 -7.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 -4.9840 -5.6870 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 -8.6820 -7.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 -9.5300 -6.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1290 -9.6250 -5.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 -8.2460 -4.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 2.0410 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -0.6590 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 2.8430 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -1.8390 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -2.4400 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -1.6500 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -3.9150 -3.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 -3.3140 -3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2990 -9.2320 -7.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8160 -8.4710 -8.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 -10.5290 -6.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9160 -9.0620 -6.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -9.9370 -5.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 -10.3460 -4.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0970 -8.0130 -3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -8.2540 -3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 19 2 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END