OTAVA-ZINC04012718 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3170 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 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 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 2.0380 0.0030 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 3.3370 3.9030 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 3.8440 -1.4620 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1760 4.4140 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3140 4.7680 -1.4590 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0270 5.7930 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8530 4.6690 -0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4620 5.4860 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3640 3.4020 0.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3830 4.6900 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8580 4.7160 1.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2900 4.2990 -2.3930 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 2.7760 -2.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 -2.0600 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -2.8010 -0.0110 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 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -6.5570 -0.0230 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 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 0.8280 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7590 3.7980 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7340 5.5780 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8220 4.7310 1.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0890 4.8420 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 3.0620 -3.3170 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 -0.6720 -2.5460 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6890 -2.5370 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -4.5590 -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 -1.7030 -4.8220 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -4.8130 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -7.4350 -0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -8.3740 -0.0240 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