ANALYTICONDISCOVERY-ZINC08299957 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 61 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3760 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 1.2200 -0.6880 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 0.0270 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 1.4180 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6580 2.1860 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 3.5830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 4.2570 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9770 3.5640 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9630 2.2390 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8300 1.5550 -0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1650 1.5520 -0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4300 2.2900 -0.0650 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3290 3.2130 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8890 2.5930 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3260 2.4620 1.3440 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5900 1.3110 0.5160 C 0 0 3 0 0 0 0 0 0 0 0 0 10.5160 0.3720 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5610 1.4160 -0.6500 C 0 0 3 0 0 0 0 0 0 0 0 0 9.2070 0.4440 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2420 2.1670 -1.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6000 1.6800 -1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9640 1.4960 -0.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 12.4640 2.3840 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7980 0.3080 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1410 0.4130 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6600 1.4930 -0.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9820 -0.7840 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3870 -2.0260 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1730 -3.1420 0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5570 -3.0380 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1570 -1.8000 0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3740 -0.6790 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5120 -1.9660 0.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7260 -3.3790 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5360 -3.9740 0.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2390 -2.1200 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -3.2560 -0.0270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9010 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 3.3610 -0.4960 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 4.1250 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8730 5.3370 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1690 0.5820 -0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6060 3.6070 1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4590 1.8710 2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6610 0.7250 -2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2650 2.4090 -2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3840 -0.5540 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3110 -2.1120 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7110 -4.1020 0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8370 0.2790 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8260 -3.6280 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6070 -3.7020 0.7240 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 40 1 0 0 0 0 2 3 2 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 46 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 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 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 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 33 2 0 0 0 0 32 37 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 34 54 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 55 1 0 0 0 0 36 56 1 0 0 0 0 38 39 3 0 0 0 0 M END