MDPI-ZINC04268294 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3940 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 1.2250 -0.6840 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0250 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 1.4280 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 2.1020 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 3.4770 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 3.4100 -1.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 2.0050 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3270 1.3070 -2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -0.0950 -2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -0.7770 -2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7400 -0.0740 -2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 1.3180 -2.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -2.1350 -1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -2.0700 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -3.2140 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -4.1350 0.9710 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 4.5300 -2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 5.4370 -3.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9240 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 -0.5060 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2870 1.9830 0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 4.3610 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 1.8470 -2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -0.6430 -2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6800 -0.6040 -2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 1.8700 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -3.0310 -2.3810 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 17 18 3 0 0 0 0 19 20 3 0 0 0 0 M END