SIAL-ZINC04513897 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2070 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0200 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 1.4090 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 4.1820 0.0130 I 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 2.1220 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 -1.0090 -0.0430 I 0 0 0 0 0 0 0 0 0 0 0 0 -1.2940 -0.7740 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7470 -1.0260 -1.4290 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9480 -1.5250 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -1.8990 -1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 -1.4050 -1.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7620 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 1.6480 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 3.0920 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -1.7270 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -0.1960 0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 0.7370 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -3.2270 -1.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 0.2550 -2.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 0.8340 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 -3.7450 -1.2670 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 15 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 2 0 0 0 0 13 22 1 0 0 0 0 21 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 M END