IBS-ZINC02292013 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5030 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 -0.7110 0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -2.0920 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7710 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -2.0570 -0.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -0.6760 -0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.1690 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -4.8820 -1.2940 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3300 -4.2510 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -6.1310 -1.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -6.9230 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -8.2950 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -9.0430 1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -8.4180 2.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -7.0500 2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -6.2920 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -4.8350 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 -4.2360 2.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4380 -9.1630 3.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -8.4620 4.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -10.3900 0.9540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -10.9660 -0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -5.2010 -1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -6.3280 -2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -6.6220 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 -5.7860 -2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8210 -4.6560 -1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4930 -4.3690 -1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4680 -6.0740 -2.2870 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4390 -5.1690 -1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 1.8700 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 1.8770 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 1.8510 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -0.1830 1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -2.6440 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -2.5820 -1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -0.1210 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -6.4000 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -8.7820 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -6.5700 3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -9.1720 5.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9910 -7.7360 4.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -7.9450 4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0400 -10.5460 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -12.0460 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -10.7460 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -6.9780 -2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -7.5020 -3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5950 -4.0040 -0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 -3.4920 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3430 -5.1260 -0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2760 -4.1760 -2.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4390 -5.5140 -2.0210 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 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 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END