ASINEX-ZINC00845556 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 -0.9880 -1.2150 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -2.0740 0.5640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8880 -1.7760 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -2.1140 -0.7800 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 -0.3660 -0.2860 -2.6740 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -3.1650 1.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 -2.8390 2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -3.7220 3.6430 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 -1.5650 3.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -0.5060 2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 0.6480 2.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -1.3060 4.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4230 -4.5330 1.0580 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 0.2060 -2.8950 -1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -2.2530 4.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 -0.7380 4.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -0.7340 5.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -5.0600 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -5.0520 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 -4.5050 0.1460 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