IBS-ZINC02213280 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.2010 1.7980 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1520 0.2850 0.4400 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1660 -0.1150 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -0.3730 1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -1.7930 1.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -2.1240 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -1.3810 -1.1490 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9790 -1.5020 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 0.0080 -0.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 -1.9530 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -2.9820 2.3250 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -4.1150 1.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -2.3800 3.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -3.4290 2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -4.4360 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 -4.7890 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 -4.1310 1.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 -3.1200 2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -2.7760 2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1860 -4.4850 1.4810 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5110 -5.7650 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6550 -6.6280 1.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9080 -6.1190 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3940 -7.4100 0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7320 -7.2490 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0040 -5.9220 0.5150 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8790 -5.5170 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9310 -5.2900 0.8300 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7000 -8.3100 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3360 -9.3170 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2420 -10.3030 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5110 -10.2980 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8830 -9.3040 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9820 -8.3100 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3440 -7.3370 1.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 2.1980 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 2.2650 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 2.0090 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6230 0.1170 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -0.2870 2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 -1.8110 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -3.1990 -0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3450 -1.8310 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 -1.4250 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -3.0130 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -4.9470 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -5.5750 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -2.6060 3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -1.9930 3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8800 -3.8100 1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8290 -8.3290 0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3460 -9.3240 -1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9590 -11.0830 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2150 -11.0730 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8750 -9.3060 0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7420 -6.5610 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 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 10 43 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 23 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 51 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 33 2 0 0 0 0 32 54 1 0 0 0 0 33 34 1 0 0 0 0 33 55 1 0 0 0 0 34 35 1 0 0 0 0 35 56 1 0 0 0 0 M END