IFLAB-ZINC04088534 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 0.1430 1.4250 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -0.0040 0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -0.6030 -1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 0.0710 -1.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -2.0140 -1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -2.7330 -2.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -4.0970 -2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -4.5090 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -3.1160 0.0980 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -5.9190 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3830 -6.2270 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -7.5450 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 -8.5610 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -8.2630 -0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -6.9490 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 -2.1290 -3.2370 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4930 -2.8850 -4.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -4.0940 -4.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 -2.2260 -5.2750 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5890 -1.5500 -5.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -1.4420 -4.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 -0.8420 -5.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3980 -1.6380 -6.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3630 -1.2540 -7.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6290 -2.0500 -8.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 -3.2310 -9.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 -3.6200 -8.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7010 -2.8260 -7.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 -3.2260 -6.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 1.7730 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 1.8140 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 1.7760 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 -4.7880 -2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 -5.4350 1.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -7.7850 1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -9.5910 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -9.0610 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -6.7170 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -1.1660 -3.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -0.6660 -4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 -2.1190 -4.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9060 -0.3320 -7.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3810 -1.7490 -9.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 -3.8500 -9.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 -4.5430 -8.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 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 21 1 0 0 0 0 19 29 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 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 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 M END