IFLAB-ZINC05153774 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -4.7670 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -4.9640 -2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -4.6930 -3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -4.2270 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 -4.0290 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6390 -4.3040 -0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8730 -3.5250 -2.1130 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.9760 -2.5260 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0800 -3.4870 -3.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0880 -3.1360 -4.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9500 -3.9100 -4.1910 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6170 -4.0760 -5.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -5.1710 -5.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -4.8560 -4.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8670 -4.4870 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -5.3260 -2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 -4.1590 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5090 -4.3690 -6.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 -3.1390 -6.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 -6.1170 -5.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 -5.2680 -6.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -3.9330 -5.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -5.6730 -4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6470 -4.5680 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8810 -4.1080 -1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7820 -5.4690 -1.9230 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 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 35 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 36 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 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 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END