MDPI-ZINC03850295 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.3340 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0120 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -0.7640 -0.1050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 -2.0270 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7360 -3.2000 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 -2.6980 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 -2.4510 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 -1.9910 1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7680 -1.7760 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1190 -2.0250 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -2.4910 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7650 -1.8160 -2.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0360 -2.0930 -3.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0500 -1.3230 -0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2320 -0.0080 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2780 0.7290 -0.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6270 0.5480 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -2.0860 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -3.0840 -0.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 -0.8030 -0.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -3.7920 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 1.8870 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.8600 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -3.8180 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 -2.6180 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6070 -1.7980 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -2.6890 -2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6660 -1.8840 -4.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 -3.1420 -3.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1470 -1.4640 -3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3510 -0.2620 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7380 1.0220 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8010 1.2840 0.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 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 26 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M END