IFLAB-ZINC04314877 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 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 0.0230 -0.7020 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0910 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7480 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.9650 -0.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0130 -1.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6700 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0400 -2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.6890 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.5090 2.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -3.4270 2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -1.4010 3.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -0.3380 2.4830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -1.3880 4.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 -0.9900 6.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9260 -0.7020 7.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 -1.9030 6.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -2.1770 5.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 -2.4220 4.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2390 -1.6020 7.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -0.5320 7.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1990 -2.5220 6.9090 N 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 -1.0160 -2.8710 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -2.0600 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -3.6390 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -0.5510 5.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -2.3220 5.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -1.8660 7.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -0.1300 6.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 0.1820 6.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9550 -0.5280 8.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4660 -2.7790 7.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 -1.3160 4.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 -3.0580 5.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -2.6030 3.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -3.2910 5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9700 -3.3780 6.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1190 -2.3280 7.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4510 -1.2440 5.2280 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 14 1 0 0 0 0 4 5 1 0 0 0 0 4 11 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 10 1 0 0 0 0 8 9 2 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 15 43 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 16 43 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 18 21 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END