MDPI-ZINC00968510 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 29 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 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 1.2090 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0180 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.3970 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 3.5650 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 4.3240 0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 5.5730 0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 6.0140 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 4.6160 0.0090 S 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 7.4330 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 8.4450 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3590 9.7660 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7050 10.0910 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 9.0920 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 7.7660 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1930 11.7570 0.0320 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.4190 -0.0220 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9030 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 3.3420 -0.5170 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 1.9420 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 8.1930 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 10.5500 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 9.3500 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 6.9880 0.0110 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 24 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 M END