MDPI-ZINC03849076 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 35 0 0 0 0 0 0 0 0999 V2000 0.7190 1.5560 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 0.3470 1.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -0.2620 0.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 0.3350 0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 1.5620 0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 2.1670 1.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 2.2040 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6300 3.5250 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8670 4.2270 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 5.4720 -0.8440 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1390 5.9700 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4740 7.2820 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7630 7.6080 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7730 6.6600 -1.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4770 5.3720 -1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1640 5.0200 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4630 3.4910 -0.5580 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 4.2480 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 3.6430 0.0880 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 5.5820 -0.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6690 -0.2610 -0.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 2.0250 3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -0.1240 2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 -1.2040 0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1740 3.1090 2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 1.6330 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7020 8.0330 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0020 8.6150 -2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7910 6.9320 -2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2630 4.6350 -1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 6.0640 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 6.0580 -0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -0.0030 -1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 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 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 M END