ASINEX-ZINC00845553 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.8860 1.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0510 -1.1880 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -2.0950 0.5800 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8260 -1.8250 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -2.1210 -0.7740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.8220 -1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2970 -0.2770 -2.6840 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -3.1830 1.5060 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -2.8610 2.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -3.7420 3.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -1.5920 3.2240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -0.5240 2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 0.6240 2.7310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -1.3500 4.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 -4.5430 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 -2.8990 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -2.3030 5.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -0.7590 5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5140 -0.8070 4.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -4.6660 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -5.2610 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -4.7130 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 14 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 17 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 16 1 0 0 0 0 14 15 2 0 0 0 0 16 22 1 0 0 0 0 16 23 1 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 M END