MDPI-ZINC03847494 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 41 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6860 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0750 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7420 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.1400 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -4.7440 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -3.9880 -2.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.6280 -2.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -1.9690 -1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6350 -1.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.8340 2.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0060 -2.7840 3.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -3.5100 4.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -4.2470 4.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -4.3420 4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -3.6400 2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -3.7490 2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3430 -4.5340 2.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 -5.2310 3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 -5.1370 4.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -3.4480 5.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1380 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -4.7360 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -5.8220 -1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0270 -4.4890 -3.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -2.0560 -3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -2.1860 3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 -3.2140 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2030 -4.6180 1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 -5.8480 3.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -5.6830 5.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -4.2380 5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7630 -3.5820 6.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6090 -2.4780 5.4190 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 1 0 0 0 0 2 11 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 M END