IFLAB-ZINC05258982 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 52 0 0 1 0 0 0 0 0999 V2000 -0.8490 0.7830 0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -0.7380 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -1.4070 1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 -1.1740 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -3.0710 -0.1980 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2580 -2.2900 -0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -4.3360 -1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0580 -4.0060 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7060 -2.8710 -2.6400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9060 -4.9720 -3.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -4.6460 -4.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 -5.5410 -5.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -5.2190 -6.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -4.0070 -7.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -3.1080 -6.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 -3.4310 -5.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -1.8810 -7.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -1.1800 -7.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -1.7170 -7.7680 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.1260 -0.0550 -8.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 0.7070 -9.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 1.9100 -9.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 3.1090 -9.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4390 -3.3730 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8710 -3.2240 2.1490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 1.0930 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1890 1.2600 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 1.0780 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -1.0330 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -2.4900 1.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -1.0960 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -1.1120 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9640 -0.9580 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7020 -0.6290 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0540 -5.0870 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6730 -4.7240 -1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 -5.8940 -3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -6.4890 -4.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -5.9160 -7.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -3.7580 -8.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 -2.7350 -4.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -1.5360 -6.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 0.2490 -8.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 1.0350 -8.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 0.0770 -9.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 1.7850 -10.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 3.2350 -8.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7720 3.9720 -9.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 -2.6160 0.0950 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -2.8500 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7090 -3.8070 1.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1270 -3.9870 1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 4 49 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 5 49 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 M END