CHEMDIV-ZINC04959269 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.0930 1.5500 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 0.0510 -0.0700 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7850 -0.1080 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -0.5090 1.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2500 -0.2840 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -2.0020 1.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2420 -2.9110 1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -4.2270 1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -4.3880 0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -2.8130 0.0260 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 0.2980 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 0.8840 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 2.1040 0.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 1.9520 2.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 1.3780 2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -0.6330 -0.2630 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -0.7020 -1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 -0.1980 -2.4390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 -1.4010 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 -1.9060 -0.7440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5310 -1.4700 -2.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8110 -2.1550 -3.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 -2.0890 -4.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7880 -2.9420 -6.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1020 -3.7130 -6.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1420 -3.0170 -5.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8850 -2.8380 -4.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5790 -2.0580 -4.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 2.0870 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 1.9020 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 1.7290 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -2.6400 2.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -5.0620 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -5.3380 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 0.9850 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8780 -0.6600 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 0.1740 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 1.0820 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 1.2730 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 2.9240 2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 1.2070 3.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 2.0820 1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -1.0370 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 -1.0670 -3.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7160 -3.1970 -2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5780 -1.6690 -2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3020 -1.0470 -4.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 -2.5760 -5.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9810 -3.4980 -6.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8820 -1.9630 -6.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3560 -3.7890 -7.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9900 -4.7120 -5.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7060 -2.2810 -3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7960 -3.8120 -3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6870 -1.0650 -4.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3510 -1.9680 -3.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 0.1050 1.3100 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4900 -2.7760 -4.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 57 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 57 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 57 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 58 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 58 1 0 0 0 0 M END