IBS-ZINC05477560 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 -0.1410 0.7150 1.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -0.0850 0.3610 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1180 0.5870 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -1.1150 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -1.9450 1.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -2.9380 1.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -0.8020 0.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -0.1210 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 1.0510 -0.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 -0.9240 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -2.2680 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2840 -2.5920 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8470 -3.7860 0.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9730 -4.6820 0.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4310 -5.9560 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 -6.9330 1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -6.6310 1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 -5.3570 1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -4.3770 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 -3.1760 0.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9140 -1.4860 -0.4480 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9940 -0.4740 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3210 0.7300 -1.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3310 -1.4260 -0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1460 -0.7250 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6190 -0.6410 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9250 -0.2120 0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7120 0.5070 1.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4550 1.9140 1.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0730 2.1910 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1880 1.5660 1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 1.2040 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 1.4880 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 0.0770 2.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -1.7480 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -0.5990 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9460 -3.5330 2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -3.6010 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 -2.4740 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4780 -6.2000 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9580 -7.9250 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5630 -7.3800 2.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -5.1240 1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6030 1.4560 -1.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2350 1.0070 -1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4280 -0.9080 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6930 -2.4490 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0410 -1.2690 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7350 0.2760 0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7690 -0.0940 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0320 -1.6510 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0710 -1.2950 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1970 0.1600 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7850 0.3620 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4690 0.1090 2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9470 3.2780 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7970 1.8300 3.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4360 1.9630 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1330 1.7340 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4300 0.0600 1.0040 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.1470 -0.3410 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 22 2 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 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 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 60 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 60 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 60 61 1 0 0 0 0 M CHG 1 60 1 M END