MDPI-ZINC04293169 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 26 0 0 0 0 0 0 0 0999 V2000 0.0210 1.5170 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.0120 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -0.6500 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4670 -0.4850 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -0.6050 -1.5180 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4670 0.1380 -1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 -0.5530 -0.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7550 -0.0010 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 1.2360 -1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0390 1.9190 -1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7610 1.3690 -1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 0.0960 -2.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 1.9030 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 1.9940 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 1.8560 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -0.4310 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -1.7400 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6630 -0.2700 1.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 -0.0530 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -1.5760 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -0.1930 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -1.5250 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5340 -0.5390 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0300 1.6640 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 2.8790 -2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 1.9070 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 3 18 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 12 2 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 M END