OTAVA-ZINC05464692 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8100 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -2.3240 -2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -3.6890 -2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -4.5520 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -4.0320 -0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 -2.6670 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -6.0200 -1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -6.6580 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -8.3820 -2.0740 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -8.2190 -2.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -6.8850 -2.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -6.5590 -2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -5.4040 -1.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 -7.5520 -2.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -8.8360 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -9.1510 -2.3690 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7610 -7.2440 -2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1560 -6.9610 -3.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3250 -7.0110 -4.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -6.6520 -4.0510 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8190 -6.3770 -5.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0630 -5.4860 -5.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4640 -5.1990 -6.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7710 -6.5160 -7.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5270 -7.4070 -7.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1260 -7.6950 -6.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -5.9860 -1.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -1.6550 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -4.0880 -3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -4.6980 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 -2.2640 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 -9.6160 -2.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3310 -8.0950 -1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 -6.3690 -1.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1000 -6.6120 -3.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0010 -5.8690 -5.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8810 -5.9940 -4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8440 -4.5480 -4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3500 -4.5640 -6.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6460 -4.6900 -7.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5890 -7.0240 -7.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0570 -6.3120 -8.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7460 -8.3460 -8.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7090 -6.8990 -8.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2400 -8.3290 -6.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9440 -8.2030 -5.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8630 -5.9520 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -6.5480 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 -4.9710 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 M END