IBS-ZINC04954912 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 0.7830 1.8130 -1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2340 0.7020 -2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 0.2200 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -0.3530 1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -1.6860 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4540 -2.4200 -2.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -3.8340 -2.3420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -4.3720 -3.5000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5570 -3.8810 -3.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -5.8420 -3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 -6.0950 -1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -4.7830 -1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 -4.6270 -0.3250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -7.1470 -1.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -6.7300 -3.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 -6.3260 -5.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -8.1500 -3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8170 -8.6370 -3.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9660 -9.9940 -2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -10.8710 -2.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -10.3950 -3.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -9.0390 -3.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -4.1100 -4.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -3.5420 -5.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -3.2820 -7.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -3.5920 -7.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -4.1690 -6.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -4.4280 -4.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -3.3030 -8.4940 N 0 3 0 0 0 0 0 0 0 0 0 0 1.4710 -2.8760 -9.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 -3.4950 -8.5500 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5900 2.4000 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 1.4090 -1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 2.4980 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 1.0790 -2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 0.1610 -3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -0.0560 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 1.3100 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 0.0440 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -1.4430 1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -0.0800 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -1.5820 -1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -2.2410 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.9630 -3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -2.3590 -1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -7.1200 -5.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 -7.9660 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 -10.3700 -2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -11.9260 -2.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -11.0820 -3.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -8.6810 -4.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5920 -3.3060 -5.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -2.8440 -7.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 -4.4250 -6.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 -4.8780 -4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -0.2850 -0.9540 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8310 -0.3530 -0.6780 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 35 1 0 0 0 0 2 36 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 56 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 56 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 46 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 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M CHG 1 56 1 M END