IFLAB-ZINC04325766 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 34 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3740 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 1.2220 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 0.0410 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4210 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 3.8230 0.0120 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 -0.7930 -0.0390 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.1590 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -2.7480 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -2.8540 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -4.2390 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -4.9940 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 -6.3300 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 -7.3550 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -8.6770 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -9.0220 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -8.0310 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -6.6890 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5810 -5.2160 -0.0470 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -10.3840 -0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -10.8650 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -9.8280 -0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9000 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 1.9820 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -2.3850 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 -7.0990 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0330 -8.2980 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -10.9860 -1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3970 -11.8050 0.0440 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 30 1 0 0 0 0 22 31 1 0 0 0 0 M END