IFLAB-ZINC05145733 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 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 0.6200 -0.6120 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 0.0510 1.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -1.9580 1.0850 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -2.5670 2.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -1.9020 2.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3510 -4.0300 2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -4.8440 2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -6.1520 2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -6.4280 1.8780 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 -4.7640 1.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -4.2280 0.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3890 -5.0410 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 -6.2470 0.5620 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5340 -4.4730 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5530 -5.1910 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4980 -4.4040 -1.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2640 -3.0870 -1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8120 -2.7600 -0.5740 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -7.2420 3.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -6.6120 4.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -5.4060 3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -4.2810 3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -2.4880 0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 -3.2670 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6100 -6.2690 -0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3660 -4.8170 -1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9050 -2.3320 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -7.7200 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -7.9830 3.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 -7.3440 4.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -6.2850 5.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -5.6940 2.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 -5.0620 4.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 -3.8820 4.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -3.4890 2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 28 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 12 2 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 2 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 M END