MDPI-ZINC03844372 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 0.1370 1.5010 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.0050 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -0.6790 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -2.0940 1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -2.7240 2.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -2.7360 -0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -2.0390 -1.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -2.6320 -2.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -0.6940 -1.1640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 0.0380 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -4.2000 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 0.0630 2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 0.2880 3.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 1.0300 4.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 1.3490 4.7010 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2670 1.3400 5.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 1.8420 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 1.8440 -1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 1.9060 0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 0.2510 -2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -0.5670 -3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 0.9740 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -4.5210 0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -4.5620 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -4.6050 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -0.5220 2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 1.0260 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 0.8730 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -0.6760 3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 1.0860 5.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 1.8180 6.1600 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 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 M END