IBS-ZINC05248821 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -4.0430 -7.2690 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6800 -6.5800 -0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -7.4380 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 -6.4150 -2.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -5.3200 -2.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5260 -4.4830 -2.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9350 -3.3760 -3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3690 -3.0880 -4.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -3.9340 -4.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 -5.0360 -4.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8040 -1.9030 -5.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6550 -1.1720 -4.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 -1.5960 -6.4570 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3180 -0.1200 -6.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1410 -0.0200 -8.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4430 1.0230 -8.5500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5030 -1.2330 -8.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -2.2900 -7.5780 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3260 -2.9490 -8.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1240 -3.0820 -6.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1000 -4.3910 -6.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2680 -4.9010 -6.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2400 -4.0060 -6.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6870 -2.4200 -6.5300 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.3170 -1.4700 -9.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4030 -1.6230 -10.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2520 -1.8710 -12.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3990 -2.0130 -13.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0960 -2.2500 -14.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 0.7960 -6.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 -7.3950 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -6.6580 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9290 -8.2450 -1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7940 -5.6030 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -8.4140 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -6.9470 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 -7.5640 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 -4.7060 -1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6930 -2.7260 -2.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -3.7170 -5.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 -5.6870 -4.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 -5.0060 -6.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3830 -5.9450 -5.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2160 -4.2220 -5.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 -2.3820 -9.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9900 -0.6270 -9.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 -0.7110 -10.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 -2.4660 -10.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 -2.7820 -11.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 -1.0280 -12.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3780 -2.3460 -15.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6760 -3.1690 -14.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7670 -1.4140 -14.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 -1.9060 -6.4790 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 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 41 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 18 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 30 2 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 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 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 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M END