MDPI-ZINC03850478 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 2.8910 1.0430 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -0.2730 0.7230 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -0.5800 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -1.5490 -1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -1.7870 -3.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -1.0640 -3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 -0.1000 -2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 0.1490 -1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 -1.3270 -5.1030 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3960 -1.5400 -5.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6890 -1.8150 -6.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 -1.9010 -7.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 -0.1470 -5.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -0.2330 -6.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 0.8450 -7.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 2.0210 -7.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 2.1010 -6.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 1.0190 -5.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 3.1830 -8.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 4.3580 -8.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5220 5.4360 -9.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 5.3510 -9.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3790 4.1860 -9.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 3.1000 -9.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -2.4970 -5.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9080 0.6880 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 1.9130 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7670 1.3190 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -2.1150 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -2.5400 -3.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0840 0.4630 -3.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6010 0.9050 -1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9320 -0.6450 -4.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 -2.3880 -4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -1.1450 -6.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 0.7770 -8.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 3.0100 -6.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0880 1.0820 -5.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 4.4260 -7.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 6.3480 -9.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 6.1960 -10.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 4.1250 -10.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 2.1900 -9.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -2.4330 -5.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9580 -1.9640 -7.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0950 -2.1390 -8.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 45 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 38 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 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 45 46 1 0 0 0 0 M END