IBS-ZINC06658725 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -0.0240 1.5340 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 0.0040 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5100 1.2480 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2890 -0.0920 2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -2.0140 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 -2.6800 1.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -2.6190 1.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -4.0160 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -4.7960 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -6.1730 1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 -6.7770 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -6.0010 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -4.6220 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -6.7610 -0.1640 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -8.1250 1.1570 F 0 0 0 0 0 0 0 0 0 0 0 0 2.1480 -0.1040 1.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 0.6760 2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9770 1.0410 3.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 1.0710 2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6860 1.8720 3.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0150 2.2140 2.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7460 1.7660 1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1570 0.9710 0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 0.6170 0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 -0.1800 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6920 -0.5010 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8990 -0.5160 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -1.2210 -0.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 1.9100 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 1.9000 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 1.8800 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -0.3730 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 -0.3430 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -2.0870 1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -4.3250 2.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -6.7790 2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -4.0170 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 2.2230 3.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4890 2.8350 3.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7860 2.0410 1.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7340 0.6270 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 16 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 37 1 0 0 0 0 16 17 1 0 0 0 0 16 27 1 0 0 0 0 17 18 2 0 0 0 0 17 19 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 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 M END