MDPI-ZINC03852437 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 -0.0740 1.3910 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 0.0060 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -0.0840 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 1.3290 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 2.0330 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 3.3530 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9070 3.4020 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 2.2010 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 4.5080 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 4.8570 1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 6.0800 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4950 -0.8440 -0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 1.9160 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 -0.5920 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 4.3310 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 5.3460 -0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 4.2860 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 4.0020 1.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 5.0400 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 6.9740 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 5.9200 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 -0.3850 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 -1.8480 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -0.7190 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 6.3600 2.8570 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7020 7.1910 2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 6.5310 3.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 5.5740 3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 13 1 0 0 0 0 2 14 1 0 0 0 0 2 24 2 0 0 0 0 3 4 2 0 0 0 0 3 12 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 2 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 11 25 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 M CHG 1 25 1 M END