IFLAB-ZINC04570178 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 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 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1010 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0230 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.8290 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -2.9000 1.3280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -4.0110 1.6820 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -3.8060 3.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -5.2570 1.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1740 -3.5850 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -2.7180 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 -2.3870 0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3770 -2.9340 -0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4450 -3.7920 -1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3360 -4.1250 -0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9710 -4.1450 -2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2780 -3.3780 -2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0290 -3.3770 -3.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4480 -2.7040 -1.6210 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5470 -1.8160 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6390 -1.8490 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3160 -1.4570 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0300 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 -2.4300 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -3.8360 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -2.3510 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -2.2960 2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 -2.3070 2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -4.8010 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 -5.2180 -2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 -3.8220 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4850 -2.1640 -1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3440 -0.7980 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9090 -2.8570 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4160 -1.1570 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0610 -0.4340 0.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4190 -1.5250 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 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 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M END