IFLAB-ZINC04159260 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2040 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4300 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -0.6840 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -1.8980 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 0.0090 -0.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0810 -0.7620 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2790 0.1890 -0.0650 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2160 0.8900 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6080 -0.6060 -0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8860 -0.8280 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6070 0.3880 -0.6500 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3000 -0.1370 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7170 1.3500 -1.4610 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0090 1.3290 -2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3580 0.8980 -1.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8460 2.7110 -0.9340 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0250 3.3030 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4350 4.5160 0.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5370 4.7700 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8160 3.6180 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8730 3.5990 -2.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6530 4.6370 -2.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4420 5.7850 -1.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0440 6.5360 -1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 5.8910 -0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1950 6.9170 -0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3230 1.0980 0.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5160 -1.8060 -0.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9890 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1240 -1.3950 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 -1.3860 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1640 2.8370 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4940 4.5810 -2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8560 0.5320 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3240 -2.3380 -0.7780 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 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 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 32 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 31 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 29 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 31 42 1 0 0 0 0 32 43 1 0 0 0 0 M END