IBS-ZINC02371282 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 -0.6130 1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 0.0510 1.9140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -2.0860 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3220 -2.7180 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -4.0820 2.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -4.8460 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -4.2140 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -2.8500 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -6.3170 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -7.0260 0.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3610 -8.4250 0.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -9.2390 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -10.5400 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -10.6010 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 -9.2100 -0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 -8.9540 -0.8440 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -9.9610 -1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4220 -9.6950 -1.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2130 -10.7240 -2.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 -12.0460 -2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -12.3430 -1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -11.3050 -0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -11.5860 -0.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 -11.9190 1.4710 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -12.9780 1.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -11.4280 2.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -12.4180 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -13.3570 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -13.7500 -1.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -13.2030 -1.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3960 -12.2650 -0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5170 -11.8760 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -8.7890 1.6180 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7740 -2.1280 2.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -4.5700 3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -4.8040 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -2.3620 -0.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 -6.8050 2.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 -8.6770 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1170 -10.5140 -2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5180 -12.8450 -2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4920 -13.3720 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -13.7840 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -14.4820 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6940 -13.5090 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3870 -11.8380 -0.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 -11.1460 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -7.8380 1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -9.4240 2.0200 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 3 4 2 0 0 0 0 3 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 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 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 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 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 26 1 0 0 0 0 16 17 1 0 0 0 0 16 25 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 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 48 1 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 32 33 2 0 0 0 0 32 50 1 0 0 0 0 33 34 1 0 0 0 0 33 51 1 0 0 0 0 34 52 1 0 0 0 0 35 53 1 0 0 0 0 35 54 1 0 0 0 0 M END