NIH-ZINC04057848 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 67 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2070 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0220 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5830 2.1320 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 2.9970 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 3.7020 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0940 3.6210 1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 2.9160 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4460 5.2390 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4580 6.2260 1.1790 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3660 5.6790 2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7710 7.0100 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8330 7.8470 2.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9440 8.6160 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0700 9.4530 3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2000 10.2340 3.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2050 10.1820 2.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0820 9.3490 1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9560 8.5610 1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6460 11.1790 2.9600 S 0 0 0 0 0 0 0 0 0 0 0 0 13.1930 11.3450 1.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2730 12.2690 3.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7470 10.2900 3.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 14.7150 9.4170 3.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1150 9.7340 3.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0970 9.6660 5.1040 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2320 10.6210 5.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7910 10.3540 5.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3610 7.1320 1.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 -0.6450 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7630 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 2.3920 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8770 3.7410 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8260 2.9580 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0890 4.3660 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1980 4.2260 2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8900 2.8760 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9410 3.6590 1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 2.2520 2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5370 5.7860 -0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 4.5470 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6100 6.3140 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8220 7.6260 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2850 9.4950 4.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2990 10.8860 4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8680 9.3100 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8630 7.9070 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4730 8.3740 3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6840 9.6040 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8280 9.0070 3.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4080 10.7360 3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3100 10.5330 6.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5220 11.6260 5.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1480 11.1610 5.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4530 9.4070 5.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3770 7.6540 0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -0.8330 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1840 4.4860 0.0170 N 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 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 9 64 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 10 64 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 12 64 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 32 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 32 62 1 0 0 0 0 33 63 1 0 0 0 0 M END