IBS-ZINC02400599 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0030 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -0.6890 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.0080 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4110 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0920 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 1.8310 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 0.6480 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -0.4000 -0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9330 0.7560 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4810 1.9680 -0.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7350 3.0570 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 3.0040 -0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9460 -0.6860 -0.0680 S 0 0 0 0 0 0 0 0 0 0 0 0 8.5850 0.0810 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6420 -0.9930 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3180 -2.1620 -0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9460 -0.6550 -0.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9280 -1.6490 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7220 -2.8860 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6930 -3.8660 -0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8690 -3.6140 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0760 -2.3820 0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1110 -1.3960 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5520 -2.0700 1.6220 Cl 0 0 0 0 0 0 0 0 0 0 0 0 12.4370 -5.4140 -1.2590 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9100 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5500 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7690 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.1720 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2190 4.0220 -0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6880 0.6980 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7040 0.7030 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2050 0.2770 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8040 -3.0840 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6260 -4.3810 0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2750 -0.4330 1.1280 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 30 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 34 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 35 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 37 1 0 0 0 0 M END