IBS-ZINC02271321 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.3440 -0.7360 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -0.3550 -0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 0.6060 -1.5250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7960 2.0430 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 2.5890 -1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 0.1530 -2.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 1.0650 -3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 0.6170 -4.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -0.7460 -4.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 -1.6570 -3.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -1.2100 -2.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 -1.2000 -5.9310 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 -1.3080 -5.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 -1.7210 -6.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7700 -2.0780 -8.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 -2.5220 -9.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 -2.8740 -10.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -2.7940 -10.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 -2.3600 -9.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -1.9980 -8.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 -1.5230 -7.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -1.4270 -7.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2370 -0.9300 -4.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7320 -0.9830 -4.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4170 -2.1560 -4.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7890 -2.2060 -4.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4760 -1.0810 -5.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7920 0.0920 -5.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4200 0.1430 -5.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 0.1570 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -1.1840 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -1.4510 1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 0.0930 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -1.2480 -1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 2.5540 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 2.2130 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 3.6590 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 2.0790 -1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 2.4200 -3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 2.1240 -3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 1.3260 -5.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -2.7170 -4.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -1.9190 -2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6390 -2.5880 -8.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -3.2170 -11.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 -3.0760 -11.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -2.3000 -9.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9380 -1.6280 -3.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9400 0.0810 -4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8800 -3.0350 -4.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3240 -3.1230 -4.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5480 -1.1200 -5.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3280 0.9710 -5.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8860 1.0610 -5.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 6 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 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 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 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 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 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 54 1 0 0 0 0 M END