IFLAB-ZINC05299457 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 -0.0620 1.5020 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -0.0040 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -0.7010 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -2.0840 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -2.7780 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 -2.0940 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -0.6980 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 0.0420 -2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 1.2550 -2.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -0.6290 -3.6250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 0.0650 -4.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -0.6290 -6.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -2.0500 -6.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -2.3620 -7.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 -0.9310 -8.5750 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 0.1330 -7.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8430 1.4650 -7.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 2.0610 -5.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.3870 -4.8400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 1.8950 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 1.8510 -0.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 1.8490 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -0.1660 2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -2.6250 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -3.8570 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -2.6360 -2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -1.5970 -3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -2.7950 -5.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -3.3720 -7.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 3.1380 -5.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 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 23 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 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 27 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 M END