MDPI-ZINC01719366 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 0.1140 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -0.4910 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 -1.8900 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9180 -2.5640 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9190 -3.9260 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -4.6270 0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -4.0660 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 -2.6670 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -2.0190 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -2.7430 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2130 -1.7950 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5970 -1.4250 -1.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3830 -2.2800 -2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7350 -1.9420 -3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3010 -0.7460 -3.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5140 0.1100 -3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1670 -0.2280 -1.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7420 -0.3200 -5.5660 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 1.1920 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4980 0.1060 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8630 -4.4500 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 -4.6800 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -2.9610 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9970 -2.4130 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0900 -0.8890 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7220 -3.2140 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3490 -2.6100 -3.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1750 1.0430 -3.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5570 0.4420 -1.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 12 2 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 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 14 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 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 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 M END