ANALYTICONDISCOVERY-ZINC05433852 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2040 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4290 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.6850 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -1.9000 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 0.0080 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1320 -0.7040 -0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0600 -1.6290 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5690 -0.9980 -1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0030 -0.8380 -1.5040 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2600 0.3180 -0.6810 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1560 1.2550 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2550 0.1930 0.5040 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8880 1.1580 0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9700 -0.5440 1.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3180 -0.0290 1.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6500 0.1620 -0.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1610 -0.7160 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4550 1.3660 -0.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 11.8370 1.2870 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4140 0.1130 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7320 -0.0060 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5170 1.1140 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8820 2.3420 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5480 2.3850 -0.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 14.6740 3.5670 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1630 4.7960 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1030 5.7870 -1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3760 5.3820 -0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4310 3.6540 -0.6270 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9880 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 0.9780 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3020 -2.0180 -1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1110 -0.2860 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3700 0.9280 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0060 -0.7440 1.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0210 2.2200 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1900 -0.9690 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5950 1.0440 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1010 4.9870 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8330 6.8160 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2390 6.0210 -1.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 44 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 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 47 1 0 0 0 0 31 32 2 0 0 0 0 31 48 1 0 0 0 0 32 33 1 0 0 0 0 32 49 1 0 0 0 0 M END