CHEMBRIDGE-ZINC02877659 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0300 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5860 -0.6320 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7720 0.1640 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9810 -0.7370 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5900 -1.1920 -1.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5830 -1.9310 -0.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6620 -1.9870 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6440 -1.2220 1.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3490 -0.9920 2.3480 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8570 -2.8750 1.4820 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8330 -3.6030 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9480 -4.4320 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0710 -4.5210 1.9300 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8880 -5.1330 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7530 -5.0340 -1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6380 -5.6970 -2.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6660 -6.4650 -1.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8100 -6.5620 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9260 -5.8970 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9110 -7.3630 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5070 -8.3550 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8760 -7.5930 -2.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5850 -7.1730 -2.7940 C 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 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 1.9720 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1680 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7800 0.7970 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 0.7880 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7080 -1.6870 2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1880 -0.9560 2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1930 -4.2370 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2550 -2.8090 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9580 -4.4410 -1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5340 -5.6210 -3.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0390 -5.9740 1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6930 -6.6870 0.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5070 -7.9090 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4010 -8.8110 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7740 -9.1280 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4600 -6.7090 -1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4560 -8.2400 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0830 -8.0580 -3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8260 -6.5030 -3.6190 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END