IFLAB-ZINC05154158 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 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 1.2300 -0.6470 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 0.1100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 1.4270 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 2.0720 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -2.1520 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -2.6330 -1.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7580 -4.1940 -1.7360 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6320 -4.3570 -3.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9700 -4.4240 -1.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -5.2470 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -5.6270 -1.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -6.4610 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3420 -6.9160 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -6.5180 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -5.6960 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -6.9650 2.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -8.3640 2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -8.4280 1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 -9.0830 2.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -7.7700 0.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 -7.9430 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 -8.1240 -1.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 -6.8490 -1.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 1.9170 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -0.5700 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3470 -0.3840 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 3.1520 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 -2.4750 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -2.5610 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0600 -2.0370 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -5.2720 -2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5930 -5.4010 0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -6.9820 2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -6.2680 2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -9.0950 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -8.5900 3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0890 -8.8250 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 -7.0600 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 -8.9680 -1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 -8.3080 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -6.0410 -1.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -7.0190 -3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 15 22 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 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 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END