MDPI-ZINC03846051 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -1.1110 0.6880 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -0.7820 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -0.9160 -1.1020 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4410 -0.0880 -0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 -0.2230 -2.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 -1.6920 -2.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -2.5210 -2.5240 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7240 -3.5680 -2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -2.3860 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -2.0140 -3.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -0.4430 -2.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 1.2780 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 1.0490 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 0.7840 1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -1.1430 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -1.3720 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 0.9590 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -0.4490 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 0.1380 -3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 0.3670 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 -1.7880 -3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 -2.0540 -1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -2.7470 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 -2.9760 -1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.2900 -4.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -2.4620 -3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -0.9290 -3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 0.4840 -2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 28 1 0 0 0 0 M END