IBS-ZINC02130664 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.9980 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -2.6920 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 -4.1680 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -4.8450 2.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -4.7920 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -6.2290 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -6.4090 -0.8200 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3180 -6.1010 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -5.5580 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -5.6560 -3.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4510 -6.5170 -3.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0760 -6.3160 -4.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -5.3100 -5.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -4.4430 -5.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 -4.6240 -4.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -3.9640 -3.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -3.2100 -3.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3250 -4.5280 -2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 -4.1060 -1.3290 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4220 -2.6220 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -1.9420 -2.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 -4.5430 -1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -7.8570 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 -8.5700 -0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 -9.8990 -1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -10.5140 -1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -9.7990 -2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -8.4720 -2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -12.1820 -2.3220 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 -2.3090 1.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 -2.4930 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -6.6150 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 -6.7660 -0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7600 -7.3040 -2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8960 -6.9610 -5.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2170 -5.1980 -6.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -3.6630 -6.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5440 -4.2820 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -4.0380 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -5.6220 -2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -8.0900 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 -10.4560 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 -10.2790 -3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -7.9160 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 M END