IBS-ZINC02110564 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.1050 1.0700 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 1.4410 2.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 1.9570 4.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 3.4170 3.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0350 4.1540 4.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 5.4960 4.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 6.1100 3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 5.3710 2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 4.0220 2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 3.2650 1.4460 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4200 3.5190 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 3.6590 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 3.4580 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2680 2.9440 1.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 3.8980 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2270 3.5810 -0.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1770 4.0210 -1.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5250 3.1440 -2.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3960 3.5440 -3.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9210 4.8280 -3.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5700 5.7070 -2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7040 5.2990 -1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7770 5.2250 -4.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 5.9670 1.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 6.5600 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 7.4220 3.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5480 7.7020 4.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8570 6.4220 5.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 0.0110 0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.2050 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4480 1.4380 -0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 1.8880 3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 0.3560 3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 1.3880 4.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 1.8330 5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 3.6760 5.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 4.7070 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 3.0380 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6870 4.9710 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 3.3680 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 2.5080 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4600 4.1100 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1150 2.1440 -2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6670 2.8590 -4.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9780 6.7070 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4340 5.9810 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7080 5.0550 -4.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 6.9990 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 7.3360 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 5.7960 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 8.0790 5.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 8.4150 5.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7720 1.8200 1.6520 N 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 53 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 53 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 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 36 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 53 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 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 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END