IFLAB-ZINC05143774 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1970 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 0.0130 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 1.4180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7790 1.8490 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5310 0.7200 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -0.3740 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0290 -1.2940 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 3.2430 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 4.2360 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 5.5070 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1740 5.7720 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 4.6880 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5890 3.4570 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3440 5.2280 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2390 6.5700 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1760 7.3460 -0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9390 6.9260 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5990 7.8340 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5400 4.5010 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7690 5.0350 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8020 4.1120 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4170 2.8360 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6610 2.7460 -0.0590 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 6.6140 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2020 7.7670 0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 6.3410 0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.7700 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6110 0.6930 -0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9410 6.1010 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8410 4.4050 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0830 1.9860 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 5.4200 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 7.0660 0.0310 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 33 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 34 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 35 1 0 0 0 0 24 25 2 0 0 0 0 24 36 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 38 1 0 0 0 0 29 39 1 0 0 0 0 M END