IBS-ZINC02267321 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 0.2220 1.1580 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -0.3470 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -1.0440 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -1.1380 1.6650 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6520 -1.1830 0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 -1.2910 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 -1.3590 -0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 -1.3240 -1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -1.2060 -2.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -1.1260 -0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -0.9340 -0.9530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -1.2920 -2.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -1.0120 -2.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -2.0400 -3.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -2.9250 -4.1540 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 -3.6880 -5.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -3.5740 -5.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 -4.2930 -6.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -4.8760 -7.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.5010 -6.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -4.8990 -6.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 0.0340 2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -2.4070 2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -3.6330 1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 -4.7970 2.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -4.7350 3.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -3.5090 4.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 -2.3460 3.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -0.5550 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 1.3260 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 1.6250 -0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 1.5940 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -0.5080 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -2.0580 1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5300 -1.3220 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8700 -1.4400 -0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 -1.3880 -2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 -1.1710 -2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -1.3350 -3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3630 -2.7540 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 -4.3860 -6.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -5.5180 -7.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7490 -4.1810 -7.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 -5.8890 -7.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -4.9240 -5.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8730 0.0010 3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4420 -0.0400 2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 0.9740 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -3.6810 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -5.7540 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 -5.6440 4.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 -3.4610 5.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.3880 4.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 0.1010 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -1.5930 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -0.3200 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 11 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 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 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 M END