IBS-ZINC05248821 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 -2.4430 0.7750 1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9400 -0.5760 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 -0.5800 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -0.7950 -0.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -2.0840 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -2.3690 -2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -3.6740 -2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -4.7160 -1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -4.4240 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7570 -3.1150 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -6.1130 -2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 -6.9570 -2.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 -6.5620 -2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 -7.8100 -3.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -7.8520 -3.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -8.7940 -4.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 -6.6960 -3.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -5.8050 -2.6590 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5360 -4.8960 -3.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -5.4620 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -4.2380 -0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -4.1650 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 -5.3300 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -6.6150 -0.0530 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0430 -6.3740 -3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2130 -5.7220 -4.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6890 -5.3860 -5.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8480 -4.7760 -6.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1970 -4.4210 -6.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -8.7040 -3.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 0.9420 2.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 0.7780 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7960 1.5690 0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 -1.3700 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 0.2130 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 -1.5430 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8520 -0.4140 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -1.5640 -2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -3.8940 -3.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 -5.2240 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 -2.8880 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -3.3690 -1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -3.2350 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -5.4650 2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 -5.6850 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -7.2890 -3.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -6.4100 -5.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 -4.8070 -4.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0270 -4.6970 -4.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2800 -6.3000 -5.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5660 -3.7130 -5.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 -5.3160 -6.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2330 -3.9650 -7.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -7.8530 -2.3900 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 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 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 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 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 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 54 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 30 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 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 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M END