IFLAB-ZINC04063458 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -2.0220 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -2.6710 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -1.9220 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -0.5380 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.1030 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7500 0.1920 0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 1.6140 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 -4.1480 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -4.7980 -0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 -4.7730 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 -6.1600 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 -6.8650 0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7520 -8.1840 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4820 -8.6310 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -7.2360 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 -9.1010 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2230 -8.6040 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2770 -9.4930 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0650 -10.7950 0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8480 -11.3060 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7370 -10.4880 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -2.5970 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6230 -2.4200 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 1.1820 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 1.9220 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0740 1.9320 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6000 2.0750 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5620 -4.2540 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 -9.6670 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4040 -7.5390 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2900 -9.1180 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7200 -12.3780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7440 -10.9130 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 M END