MDPI-ZINC03846792 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.6880 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7740 -2.0940 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0290 -2.6660 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0370 -2.0000 -0.0650 O 0 3 0 0 0 0 0 0 0 0 0 0 6.0830 -0.7900 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9280 -0.0140 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4050 -0.1180 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5750 -0.8750 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8020 -0.2440 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8720 1.1380 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7140 1.8940 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4820 1.2740 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9840 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8810 -2.7020 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1120 -3.7430 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9770 1.0650 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5210 -1.9540 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7090 -0.8300 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8350 1.6270 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7750 2.9730 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5780 1.8660 -0.0610 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 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 22 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 26 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 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 31 1 0 0 0 0 M CHG 1 10 1 M END