MDPI-ZINC03852346 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 34 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 0.2460 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -2.0110 0.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8930 -2.5150 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6430 -2.5270 -1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8910 -3.9710 -1.4380 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -4.7370 -2.8510 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -6.1150 -2.5340 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3260 -3.9680 -3.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -4.6120 -3.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -5.5920 -3.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -5.4940 -4.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -4.4160 -5.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -3.4370 -5.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -3.5370 -4.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -4.3080 -6.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 -2.3460 0.7390 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -2.0230 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -2.3240 -1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -4.4780 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -6.4340 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -6.2590 -4.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -2.5950 -6.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -2.7740 -4.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -4.8040 -7.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 -3.2570 -6.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3390 -4.7860 -6.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 7 26 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 9 11 2 0 0 0 0 9 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 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 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 30 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 M END