IBS-ZINC02235864 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 0 0 0 0 0 0999 V2000 0.7680 2.7240 -2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 1.3590 -1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 1.2090 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -0.0420 0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -1.1500 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -1.0210 -2.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 0.2470 -2.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 0.3680 -4.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 1.2420 -4.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -0.7070 -4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -0.5630 -6.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -2.0000 -4.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -2.1870 -2.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -3.1770 -5.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 -3.2880 -5.7390 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -2.5910 -6.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 -3.4450 -8.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -4.6520 -8.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 -5.5250 -9.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -4.0290 -5.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -4.5550 -4.0190 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -4.2040 -5.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 -5.4820 -5.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3240 -5.6440 -6.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0520 -4.5390 -6.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5030 -3.2610 -6.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2350 -3.0920 -6.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2190 -2.1810 -6.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5940 -0.9020 -6.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3020 -4.7030 -7.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8030 -6.0400 -7.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 2.9070 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 2.7700 -3.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 3.4820 -1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 2.0740 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -0.1420 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -2.1200 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -3.1720 -2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -3.0350 -6.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 -4.0890 -4.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6970 -2.4230 -6.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -1.6330 -7.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -2.8900 -9.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -3.6870 -8.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -6.4180 -9.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -5.0130 -10.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -5.8110 -9.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 -6.3430 -5.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7530 -6.6320 -6.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 -2.1020 -5.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6760 -0.8860 -7.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2710 -0.1290 -7.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3600 -0.7140 -5.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1490 -6.6400 -7.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8340 -6.4690 -6.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8080 -6.0290 -7.6540 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 37 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 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 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 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 23 48 1 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 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 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 30 31 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 M END