IBS-ZINC05451976 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.3780 1.5070 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 0.0290 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -0.4630 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -0.9420 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5850 -1.5680 -2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9590 -1.6810 -3.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8550 -2.0130 -2.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5560 -1.8950 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6960 -2.3160 -1.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 -1.3370 -0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 -0.8430 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -0.3350 1.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8800 -1.2590 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6860 -0.1470 1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4860 -0.0740 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 -1.1060 3.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6830 -2.2140 3.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8760 -2.2910 2.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 -3.4970 1.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.4360 -2.3700 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -1.1640 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 -1.0240 -3.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1440 -1.7410 -3.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -2.6110 -2.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -2.7500 -1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 -2.0330 -1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7920 -3.3810 -2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4790 -3.2600 -3.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 1.6240 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 2.0860 -0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 1.8630 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -0.5500 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -0.0870 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2700 -2.4280 -3.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6880 0.6590 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1130 0.7910 2.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1110 -1.0460 4.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6840 -3.0190 3.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5480 -4.2500 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -3.9080 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 -3.2030 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 0.0900 -3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -0.3510 -4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7530 -1.6320 -4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -3.4210 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -2.1430 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1740 -4.2200 -1.8900 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0010 -4.7030 -2.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 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 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 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 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 47 48 1 0 0 0 0 M END