OTAVA-ZINC04012719 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3170 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -0.6770 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 0.0500 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 1.4530 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 2.0380 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 1.8990 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 0.8020 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -0.2820 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0120 3.2980 -0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3960 3.8880 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 3.8780 1.4120 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2290 3.3220 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3780 3.6920 1.9600 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3700 3.0440 2.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1400 3.0210 0.7960 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1420 1.9380 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4030 3.3910 -0.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5740 3.5500 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2950 2.8350 -0.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 4.9570 2.2790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 5.2640 1.3740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -2.0600 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -2.8010 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -4.3030 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1380 -5.0770 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -6.5570 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2880 -6.9520 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 1.8230 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 0.8280 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5570 4.6110 0.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0620 3.4130 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2140 3.1190 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8600 4.8990 2.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 5.6800 2.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.5400 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -2.5460 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -2.5370 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -4.5580 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -4.5680 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -4.8220 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 -4.8120 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -7.4350 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -8.3740 -0.0230 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 29 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 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 19 20 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 28 2 0 0 0 0 27 43 1 0 0 0 0 43 44 1 0 0 0 0 M END