CHEMBRIDGE-ZINC04196694 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 0.1720 1.0220 2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -0.3380 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -0.8660 1.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 -2.2260 0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7610 -2.7470 0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -2.0950 1.1510 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -3.9380 0.0760 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 -4.4680 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4350 -3.6220 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7120 -4.1430 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8980 -5.5150 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8010 -6.3650 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5200 -5.8440 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -6.6750 0.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -8.0750 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1930 -6.0400 0.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4350 -7.3020 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5560 -7.9470 -0.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7680 -7.9000 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7800 -7.1610 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0240 -7.7220 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2770 -9.0210 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2710 -9.7640 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0230 -9.2060 -0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7700 -10.9960 -0.3360 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2020 -10.8570 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4020 -9.7880 0.6670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 1.3990 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 1.7240 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 0.9130 3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -0.2280 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -1.0390 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 -0.9760 2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -0.1650 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -2.1170 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -2.9270 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -4.4280 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2930 -2.5550 0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5660 -3.4830 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 -7.4310 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 -8.2710 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3110 -8.4000 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7660 -8.6230 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9150 -5.4970 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5870 -6.1510 1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8050 -7.1490 1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2450 -9.7790 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6020 -10.5860 -1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6610 -11.7770 0.0850 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 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 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 M END