OTAVA-ZINC05016608 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 0.6480 0.1860 -1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -0.1260 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -0.5850 0.6440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -1.0520 1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -1.3220 2.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -1.7960 3.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 -2.0510 3.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -1.9950 4.1560 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2530 -3.0450 4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -1.4640 3.2190 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -1.1230 5.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -1.4310 6.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -2.2650 6.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -0.7780 7.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -1.0610 8.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -0.4570 9.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 -0.9480 10.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -1.8800 9.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -2.2130 8.2940 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 0.5740 10.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 0.9390 9.5280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 1.1200 11.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 2.1370 11.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -1.0820 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -2.2950 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -0.7140 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 0.5270 -2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 0.9660 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 0.7740 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -0.9060 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -0.0720 5.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.3310 5.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -0.1110 7.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -0.5900 11.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 -2.3710 10.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 2.9710 11.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 1.7120 11.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 2.4920 12.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -0.9230 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 -0.1990 0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 -2.0830 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -2.5080 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 -3.1600 0.5850 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 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END