IBS-ZINC05164994 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 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 0.0230 -0.7030 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0930 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7480 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.9650 -0.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0140 -1.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.4620 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6700 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0420 -2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.5190 2.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -1.3990 3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.3330 2.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -1.3810 4.6320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.1590 5.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -0.1430 6.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 1.1440 7.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 1.1650 8.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 2.3710 9.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 3.5600 8.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 3.5460 7.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 2.3460 6.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 5.0740 9.5390 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -3.9060 2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 -4.3690 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 -5.7220 3.5650 O 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 0.0800 -2.2150 5.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -1.0710 7.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 0.2390 9.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 2.3890 10.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 4.4760 6.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 2.3370 5.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -3.9700 3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 -4.5430 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -4.3050 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -3.7320 3.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 -6.0820 3.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 M END