IBS-ZINC04599301 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.4680 1.4210 -0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6000 -0.0770 -0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 -0.9050 -0.2450 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3740 -2.3260 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -2.2140 -1.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -2.9610 -1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -0.8840 -1.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0100 -3.3420 -0.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 -0.7520 1.2620 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1860 -1.5850 1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3930 -1.4580 1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4780 -2.2220 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3600 -3.1180 2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1510 -3.2470 3.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 -2.4840 2.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 -2.6120 3.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 -3.5560 4.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4280 -3.8680 2.8380 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6420 -3.6830 2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 0.6960 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 1.4330 2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 2.6750 2.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 2.7070 1.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8880 3.4170 3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 1.5210 0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0650 1.1530 -0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 0.9520 3.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 1.7280 -1.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 1.8950 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7250 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -0.6220 -0.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -1.0860 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 -0.7610 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4200 -2.1200 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0560 -3.9430 3.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -3.2780 5.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -4.5500 4.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -3.5590 4.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4120 -4.3400 2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9660 -2.6460 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4740 -3.9210 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 0.8870 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 1.1190 2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.5010 4.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -0.1130 3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 8 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 25 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 25 2 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 M END