CHEMBRIDGE-ZINC05027986 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.8090 2.4770 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 0.9850 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -1.1130 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -1.7930 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7320 -1.7500 1.2930 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9540 -0.3630 1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 0.3170 1.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 -2.4270 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2480 -3.5210 1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4540 -4.1870 1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3550 -3.7670 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0580 -2.6840 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 -2.0090 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4940 -0.6440 -0.8300 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.3340 -3.9460 2.9220 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7560 -4.2040 4.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4240 -4.1220 4.5520 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -4.5290 5.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -4.7880 6.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4720 -4.7290 6.6540 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 -5.1400 7.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6210 -5.4230 8.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -5.7230 9.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -5.6870 8.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 -5.2740 7.2000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 3.0040 1.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 2.8730 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 2.6170 1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 0.8450 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 0.5890 1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -1.6510 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -1.1180 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -1.2700 -0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -2.8300 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5030 0.1750 0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5300 -0.3580 2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 1.3540 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0660 -0.2050 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6900 -5.0340 2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2930 -4.2880 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7640 -2.3600 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3970 -4.0530 2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9200 -4.5760 4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -5.4120 9.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -5.9690 10.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -5.8970 9.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 0.2740 0.7220 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 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 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 7 47 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 15 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 M END