CHEMBRIDGE-ZINC03110214 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 49 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3840 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -0.6900 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0110 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4150 -0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.0950 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 1.8420 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5380 0.7060 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -0.3840 -0.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -1.3050 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 3.2260 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4510 4.2190 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 5.5370 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 6.5670 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 6.3530 0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5620 7.9570 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9170 8.2330 0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3510 9.5710 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 10.5830 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 10.4070 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 9.0970 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 8.9170 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 10.0060 -0.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 11.2950 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 11.5060 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7960 9.8520 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3520 11.0820 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7260 11.0920 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2980 9.8850 0.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0600 8.6360 0.3290 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9080 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7700 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1750 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6170 0.6740 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3520 3.4160 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 5.7080 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6340 7.4280 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 7.9220 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 9.8670 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 12.1420 -0.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7080 12.5120 -0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7660 11.9870 0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2990 12.0070 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3600 9.7040 0.4620 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 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 43 1 0 0 0 0 28 29 2 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 M END