MDPI-ZINC04268112 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0600 1.5000 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 0.0010 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -0.6610 1.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 0.0120 2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 1.0460 2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 1.7210 3.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 1.3780 4.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 0.3570 4.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -0.3270 3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -1.3270 3.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -1.6170 4.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -0.7140 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -0.0380 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -0.8060 -3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -0.1770 -4.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -0.9300 -6.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -2.3160 -5.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -2.9550 -4.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -2.2090 -3.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -2.8260 -2.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -2.1800 -1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -2.7870 -0.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 1.9680 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.8200 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 1.7940 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 1.3160 1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 2.5200 3.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 1.9120 5.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 0.0950 5.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2560 -2.4330 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 -1.9080 5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -0.7310 4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 1.0380 -2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 0.9010 -4.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -0.4450 -7.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 -2.8990 -6.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -4.0330 -4.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 M END