ANALYTICONDISCOVERY-ZINC05433819 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.0830 1.3850 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.0720 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -0.6390 0.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -0.8050 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -2.1600 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 -2.8380 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -2.1850 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 -0.8390 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 -0.1520 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 -2.8810 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0020 -2.2280 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0190 -1.0130 0.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1530 -2.9220 0.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1420 -4.3900 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1060 -4.9580 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3670 -2.8810 -0.7630 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.9700 -2.6940 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4510 -2.2320 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7500 -2.2930 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6200 -2.8970 -0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0200 -1.0960 -1.2110 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.3650 -0.5250 -1.1040 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.7950 -0.7890 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2810 0.9980 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7020 1.5510 -1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2500 1.1020 -2.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0830 -0.3360 -2.9080 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.2290 -1.0760 -2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1480 -2.2580 -2.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 1.7550 0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 1.5000 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 1.9540 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -2.6670 0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 -3.8820 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4710 -0.3370 -0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3640 0.8940 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 -3.8360 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1360 -4.7630 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4660 -4.6890 1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7250 -4.7460 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1950 -6.0360 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8980 -2.3280 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3100 -1.1790 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3240 -0.6130 -1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8270 1.4130 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6820 1.2660 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3380 1.1650 -0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6790 2.6400 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3090 1.3510 -2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7140 1.6210 -3.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6270 -0.7830 -3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4260 -4.3330 -0.5230 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1100 -4.7720 -1.1200 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 52 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 52 53 1 0 0 0 0 M END