IBS-ZINC02213788 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3760 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 1.2210 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.4190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 2.1440 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -2.1630 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -2.7540 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -2.8550 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 -4.3030 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -4.9100 -0.0110 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7940 -4.5090 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -6.4310 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -6.9870 -0.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8690 -4.5820 1.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9010 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 -0.4880 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1680 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 1.6770 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5600 3.1140 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -4.6260 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -4.6350 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -6.6800 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -6.8410 0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -7.9500 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -4.9090 2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 17 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 20 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 M END