IFLAB-ZINC05153564 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.7430 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -0.9120 1.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -1.6540 3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -2.2280 4.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.8240 -1.4370 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.1160 -1.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 0.0550 -2.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -1.0600 -1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -2.2000 -1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -2.3860 -1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 -1.4280 -2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 -0.2860 -3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.1060 -2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6060 0.5420 -3.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9020 -0.2980 -3.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 -1.5220 -3.1770 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2920 -2.6550 -2.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4830 -2.6890 -3.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5680 -3.8780 -2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -3.5500 -1.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -1.7250 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.1920 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 0.0700 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 -1.4630 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8510 -2.9360 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 0.7780 -3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2310 0.6980 -4.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7840 1.4980 -3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1800 -0.5260 -4.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7090 0.2360 -3.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0850 -4.3750 -3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2960 -4.5610 -2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0030 -3.3030 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8720 -4.4210 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 3 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 M END