OTAVA-ZINC05010454 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.3260 0.8980 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 1.0570 -1.3210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2110 2.1120 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 0.2730 -2.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 0.3210 -3.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -0.3340 -3.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 0.4440 -2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 0.5300 -1.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2210 0.1290 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7050 0.2930 0.8130 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -0.5050 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 0.2340 -0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 1.6930 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3370 2.3880 -1.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2220 3.7550 -1.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2830 4.4440 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 3.7590 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 2.3930 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 5.7930 -1.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 6.4390 -0.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 -1.8740 -0.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 -2.6130 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -2.0750 0.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 -4.0770 0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -4.8310 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 -6.1970 0.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9640 -6.8210 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 -6.0770 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9390 -4.7100 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1120 -8.5400 0.8340 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.3810 1.1720 0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 1.5480 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.1380 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 0.7190 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -0.7630 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 1.3590 -4.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -0.2160 -4.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7600 -0.3200 -4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -1.3650 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 1.4480 -3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1900 -0.0750 -2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5750 -0.2490 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0670 1.8530 -2.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8630 4.2930 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 4.2990 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 1.8610 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 6.2560 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 6.0420 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2060 7.5110 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 -2.2910 -0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -4.3460 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -6.7820 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9830 -6.5690 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 -4.1310 -0.2640 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 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 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 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 M END