IBS-ZINC05047385 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 -0.1490 1.5780 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 0.1920 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -0.3540 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -1.6250 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5090 -2.3550 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -1.8110 -1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -0.5350 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -2.5470 -2.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -1.9100 -3.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -0.7000 -3.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -2.7030 -4.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -1.5710 -6.3270 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -2.7320 -7.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -4.0400 -7.4940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -4.5820 -8.6330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 -3.6520 -9.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -2.4390 -8.9270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -1.1100 -9.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -0.6510 -9.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -0.7710 -11.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -0.2120 -10.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 0.2150 -9.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -0.0480 -9.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -3.8680 -10.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5170 -5.0930 -11.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -5.2500 -12.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -4.2680 -13.6400 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0730 -3.0990 -13.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -2.8520 -11.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -3.7400 -0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 2.3080 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 1.6470 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 1.7810 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 0.2150 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -2.0470 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -0.1110 -2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -3.5160 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -3.3760 -5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -3.2850 -4.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -1.1570 -10.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0610 -0.4070 -8.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9780 -1.2100 -11.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4460 -0.1430 -11.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 0.6930 -9.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -5.9010 -10.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1590 -6.1910 -13.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -2.3230 -13.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -1.8910 -11.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -4.4700 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 -3.9460 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9780 -3.8050 0.2960 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 M END