IFLAB-ZINC04941858 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 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 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2440 -0.0640 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -2.0230 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -0.0910 -1.2090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 0.0550 -2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 0.4460 -2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 0.5760 -3.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2110 0.3300 -4.7120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -0.0320 -4.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2720 -0.1740 -3.5590 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1450 0.9580 -3.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2120 1.0490 -1.8760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0650 0.7450 -1.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2320 1.2220 -4.2210 C 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -2.3750 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -2.4560 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -2.3260 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 0.0750 -0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -0.2240 -5.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2180 2.2740 -4.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1870 0.9850 -3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0990 0.6030 -5.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 26 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 27 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 M END