OTAVA-ZINC05372885 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 2.5290 0.1070 -1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 -0.6260 -0.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -1.2770 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -1.8350 0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -1.5260 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -0.7640 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -0.2280 -2.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 1.1160 -2.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 2.1760 -1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 1.9440 -0.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 3.3940 -2.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 3.5930 -3.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 2.0000 -4.1440 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 4.8010 -4.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 6.0530 -3.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 6.8430 -4.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8240 7.0120 -5.4910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 5.7160 -6.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 4.8800 -5.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 7.8650 -6.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 8.1560 -7.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 9.0000 -8.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 9.5550 -7.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6410 9.2670 -6.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7780 8.4280 -5.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 -0.5410 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 0.9820 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 0.4260 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -1.3400 1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -2.4170 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -1.8220 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -0.8840 -3.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 6.6410 -3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 5.8260 -2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 7.8220 -3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 6.3000 -4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4580 5.8780 -7.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 5.1890 -6.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 3.8770 -5.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 5.3520 -5.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 7.7230 -8.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 9.2270 -9.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0960 10.2140 -8.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 9.7020 -5.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 8.2070 -4.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 M END