ASINEX-ZINC04906278 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -0.8530 1.2080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -0.7470 2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 -1.3250 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 -1.6220 2.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 -1.4660 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2790 -1.9420 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9200 -2.0530 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2720 -1.6950 -2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 -1.2220 -2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3090 -1.1000 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -0.6340 -1.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -0.5880 -1.4870 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4730 0.0220 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -0.2080 -2.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 -0.7030 -2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 0.2600 -1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 0.9560 -0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 1.1700 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 1.7900 1.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 0.6960 -0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7300 0.0310 -2.7740 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 -2.2220 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9340 -2.4220 -1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7900 -1.7890 -3.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -0.9470 -3.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 1.3350 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5400 -0.4640 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6250 0.3650 -2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 15 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 24 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 34 1 0 0 0 0 25 35 1 0 0 0 0 M END