IFLAB-ZINC04248794 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 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -2.0030 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.6260 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -1.8690 3.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.4880 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.1390 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -2.5500 4.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 -2.7510 3.9820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 -3.8880 3.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8780 -3.6450 3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1260 -2.3970 3.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0050 -1.8470 4.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8310 -0.2160 4.7860 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5500 0.3450 4.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6460 1.7590 5.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6510 2.3310 5.5950 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8380 2.3870 5.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9270 3.6870 5.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0150 4.3730 5.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9410 5.6290 6.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9770 6.5720 6.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7070 7.8150 6.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4140 8.1650 7.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3880 7.2600 7.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6430 5.9940 6.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5700 4.6350 6.2880 S 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 0.2300 -2.5950 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -3.7040 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.1000 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 1.2170 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -1.9280 5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -3.5160 4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 -4.8010 3.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6100 -4.3350 2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1790 -0.3060 5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8850 0.3120 3.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6340 1.9300 4.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9880 6.3140 6.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5090 8.5280 7.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2130 9.1460 7.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3820 7.5340 7.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 M END