IBS-ZINC05248531 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 0 0 0 0 0 0999 V2000 0.4260 2.8680 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 1.3710 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 0.6300 0.9270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -0.7260 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -1.3290 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -2.7070 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -3.4880 0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -2.8940 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -1.5120 1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -0.9060 2.9820 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1950 -0.6500 2.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8590 -0.9360 1.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -0.0130 4.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 0.2800 4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9750 -0.1610 3.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3810 0.2500 3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0730 -0.3850 1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5190 0.0380 1.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0360 1.0650 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3840 1.1430 1.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9750 1.8050 1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7780 0.1430 2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6260 -0.5900 2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7220 -1.6740 3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9370 -2.0170 4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0760 -1.2960 3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0050 -0.2260 2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 0.2970 5.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 0.8240 6.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 -0.0170 5.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -0.5920 4.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 -0.8450 4.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 3.0980 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 3.4340 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 3.1400 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 1.1420 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 1.0990 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -0.7220 -1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -3.1760 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -4.5640 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -3.5060 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5710 0.8630 4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6280 -0.7500 2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4410 1.3360 3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8750 -0.0770 4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0130 -1.4700 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5790 -0.0580 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4710 1.7310 0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8400 -2.2400 3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0120 -2.8560 4.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0290 -1.5790 4.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8960 0.3300 2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 0.1810 5.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 31 32 2 0 0 0 0 M END