CHEMBRIDGE-ZINC02955896 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 0 0 0 0 0 0999 V2000 2.7920 6.5060 2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 6.8950 3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 6.2360 3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2200 5.1730 2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 4.7860 1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 5.4540 1.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5100 4.4640 2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7240 3.4380 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0070 2.7340 1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8800 3.0740 2.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2210 1.7090 0.7490 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4020 1.0610 0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6310 1.5380 1.8530 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6170 0.0360 -0.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8820 -0.5630 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9900 -1.9460 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2330 -2.5440 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3810 -1.7680 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2790 -0.3750 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0210 0.2240 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4990 0.4580 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7050 0.0020 -0.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7160 0.8870 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1070 0.6440 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9910 1.6780 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5470 2.9900 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1980 3.2580 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2770 2.2130 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5150 2.2140 -0.0860 S 0 0 0 0 0 0 0 0 0 0 0 0 14.6030 -2.3580 -0.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 7.0240 2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 7.7180 3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7650 6.5410 3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 3.9650 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 5.1570 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2850 4.7660 3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9500 3.1370 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5250 1.4390 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8960 -0.2870 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0990 -2.5560 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3100 -3.6190 -0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9360 1.2990 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4710 -0.3700 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0510 1.4750 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2600 3.8000 -0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8530 4.2780 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9340 -2.4750 -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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 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 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 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 39 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 30 47 1 0 0 0 0 M END