MDPI-ZINC03844989 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 1 0 0 0 0 0999 V2000 0.6390 2.5420 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 1.2230 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.2330 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5430 0.5620 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9340 1.8810 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 2.8710 -0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 -0.5180 -0.1200 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1100 -1.4120 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1970 -0.8380 -1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 -0.3600 -1.7610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 -1.7270 -2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -2.3840 -2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -3.2300 -2.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1120 -3.4590 -4.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 -2.8250 -4.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 -1.9520 -3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 -1.3630 -4.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5350 -1.6550 -5.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 -2.5200 -6.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 -3.1190 -5.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 -4.0750 -6.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -4.3000 -5.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6140 -0.0560 0.7900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 -0.3090 2.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 -0.8990 2.4730 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4410 0.1310 3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2550 -0.1300 4.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2020 0.2830 5.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3330 0.9550 4.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5240 1.2170 3.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5880 0.8040 2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 3.3150 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 0.9660 -0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -0.7980 -0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 2.1380 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 3.9020 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -2.2300 -1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -3.7170 -2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7550 -0.6890 -3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4280 -1.2000 -5.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 -2.7220 -7.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -3.6340 -7.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1300 -5.0170 -6.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -5.3520 -5.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -3.9690 -5.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3710 -0.6530 4.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0590 0.0820 6.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0720 1.2760 5.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4090 1.7420 3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7400 1.0050 1.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 23 1 0 0 0 0 9 10 2 0 0 0 0 9 11 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 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 22 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 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 30 2 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 30 49 1 0 0 0 0 31 50 1 0 0 0 0 M END