IBS-ZINC01247857 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1400 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -0.4800 3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -1.8580 3.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -2.6270 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.0010 1.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 -4.1080 2.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 -4.7600 3.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -6.4910 2.9760 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -6.1640 1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -4.8780 1.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -7.1880 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7650 -8.5110 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -9.4590 -0.1580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5260 -10.8160 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -11.2000 1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -12.5400 1.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8640 -13.5060 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -13.1260 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -11.7810 -0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -14.0590 -1.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 -15.3820 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -15.7670 0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -14.8230 1.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -6.7930 -0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -6.4800 -1.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 1.2180 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1150 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -2.3400 3.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -2.5930 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -4.3010 4.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -8.8090 1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -9.1920 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -10.4510 2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 -12.8370 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -11.4830 -1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 -16.0810 -1.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -15.4030 -1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -15.7400 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -16.7690 0.4070 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 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 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 27 28 3 0 0 0 0 M END