CHEMBRIDGE-ZINC01000449 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 37 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 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.1240 2.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2110 0.9530 2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -0.5140 3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -1.2940 4.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9670 0.0060 3.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6680 -0.4150 5.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -0.8210 2.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 -0.2980 1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 0.7520 1.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 -1.0010 1.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8240 -2.2070 2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 -2.8580 2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 -2.3190 1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9850 -1.1250 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7760 -0.4600 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 1.3530 0.1380 I 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 -0.1430 6.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -1.4960 5.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6390 0.0770 5.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -1.6580 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 -2.6300 3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1500 -3.7910 3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0680 -2.8330 1.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8310 -0.7100 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 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 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 M END