IBS-ZINC01813091 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.4580 0.8070 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 -0.6030 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -1.2190 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -2.4790 1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -2.6550 0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -1.4650 -0.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -3.8770 -0.7630 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2860 -4.6380 -0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -4.3880 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -3.5780 -1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -2.4550 -2.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -4.5590 -2.8590 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -4.2810 -3.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 -5.1930 -4.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9170 -6.3110 -5.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -7.4340 -5.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -8.4770 -5.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -8.4140 -5.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -7.2980 -4.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -6.2540 -4.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -9.4720 -5.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -10.6480 -6.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -9.4070 -4.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -3.5030 2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -0.6000 2.9930 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0950 -0.6900 3.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -0.0020 3.2010 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3290 1.4820 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 0.8600 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 1.0990 1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -4.6040 -0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -3.6270 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -5.2970 -1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -5.4570 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -5.1320 -5.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1940 -7.4830 -6.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -9.3440 -6.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -7.2520 -3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 -5.3900 -3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -11.3820 -5.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -11.0850 -6.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -10.3510 -6.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6310 -8.5450 -5.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -10.3180 -4.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -9.3120 -3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -4.0850 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 -4.1670 1.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -2.9970 2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 24 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 9 1 0 0 0 0 7 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END