OTAVA-ZINC01961451 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 1.4870 1.7930 1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 0.3130 1.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -0.4780 1.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.8250 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -2.6510 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -4.0200 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -4.5690 1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -3.7410 1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9620 -2.3730 1.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 -5.9570 1.7540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -6.7810 0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -6.3240 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -8.2710 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -8.9410 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -9.3270 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -9.9240 -2.0690 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4780 -10.1930 -2.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -9.8250 -0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -9.1750 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -8.8350 1.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6130 -10.1890 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -10.7980 -2.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 -10.9770 -3.1850 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3210 -11.2720 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 -9.9070 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6520 -9.0180 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5710 -8.7600 0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4540 -9.3800 2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4160 -10.2630 2.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4940 -10.5330 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 2.0780 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 2.3960 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 1.9580 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 0.0270 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 0.1470 2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -2.2240 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -4.6630 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -4.1680 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 -1.7300 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -6.3250 2.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -8.6190 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -8.5020 2.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -9.1330 -1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8580 -10.4740 -3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2530 -12.1430 -3.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8560 -11.5400 -1.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7440 -8.5330 -1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3830 -8.0710 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1760 -9.1740 2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -10.7440 3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 -11.2250 1.4880 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 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 2 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 M END