IFLAB-ZINC04497717 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.6870 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -2.0680 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.0820 1.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.7000 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1700 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -4.9930 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -6.4090 -0.7360 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0700 -7.1730 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -6.3980 0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -4.9330 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -4.5080 2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 -6.5980 -0.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -8.0790 -1.0930 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 -7.9470 -0.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -8.5060 -2.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -9.1980 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 -9.4430 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0680 -10.3640 2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -10.8670 1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -10.1700 0.1250 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 1.8510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 1.8680 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 1.8780 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.1400 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 -2.6010 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.6250 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -4.6050 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9060 -5.0140 -1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -6.9530 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -6.8130 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 -5.8570 -0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 -8.9590 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 -10.6530 3.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -11.5940 2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 M END