MDPI-ZINC03852700 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 2.9860 1.1650 0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2820 -0.2270 0.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 -0.7740 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 -2.1230 -0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 -2.6830 -1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8040 -1.8930 -2.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -0.5360 -2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 0.0140 -1.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 -2.4430 -4.1620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 -3.7250 -4.2940 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -4.4860 -3.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2270 -3.8910 -2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -4.6650 -1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -6.0290 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -6.6250 -2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -5.8640 -3.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 1.7400 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 1.3430 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 1.4740 1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7310 -2.7330 0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -3.7310 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 0.0790 -3.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 1.0610 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -2.8270 -2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.2070 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -6.6300 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -7.6900 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -6.3320 -4.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 8 23 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 14 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 28 1 0 0 0 0 M END