CHEMDIV-ZINC06799680 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -1.2130 2.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 -0.1610 1.4260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7270 -0.6470 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 -0.1250 2.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4360 1.0840 3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7330 1.5620 3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7350 0.8320 2.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4400 -0.3770 1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 -0.8580 1.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 -1.2890 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0850 -1.5800 -1.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -1.7720 -0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 -2.5590 -1.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2210 -2.6740 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2080 -1.9700 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 -1.4130 0.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -0.6120 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -0.1960 1.0730 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 2.4760 0.4060 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2170 -0.2950 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -1.7360 2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 1.6540 3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9640 2.5070 3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7480 1.2060 2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2220 -0.9480 1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 -1.8040 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 -3.0030 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0590 -3.2280 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0400 -1.8680 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0610 -0.3330 1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 M END