IBS-ZINC03637217 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 36 0 0 0 0 0 0 0 0999 V2000 0.0500 1.3690 0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -0.0090 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -0.6930 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 0.0180 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 1.3960 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 2.0700 0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 2.2840 0.5800 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -2.1740 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 -2.9610 0.2860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -4.2170 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -4.2720 0.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -2.9190 0.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -5.4810 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -5.6280 0.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -6.6150 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -7.9340 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -8.9450 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -10.2330 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -11.1760 -0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -10.8520 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -9.5780 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -8.6270 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -11.7820 0.3860 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -5.8760 0.1000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 1.9000 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -0.5550 0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -0.5080 0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 3.1480 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 -8.2410 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -10.4860 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -12.1700 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -9.3330 1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 -7.6370 1.0900 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 22 33 1 0 0 0 0 M END