MDPI-ZINC03844697 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 39 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2060 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0310 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4200 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0890 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -0.6510 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -1.9340 -0.0420 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 -2.2650 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7450 -3.4610 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1000 -3.4140 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7950 -2.1930 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1250 -0.9860 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7210 -0.9800 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 -0.0620 -0.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2780 -2.2000 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9700 -3.4100 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3480 -3.4150 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0490 -2.2140 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3610 -1.0060 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9820 -0.9970 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4440 -2.2210 -0.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -1.7600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 1.9750 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2350 -4.4130 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6580 -4.3380 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6740 -0.0570 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4260 -4.3440 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8850 -4.3520 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9070 -0.0740 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4480 -0.0580 -0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9250 -3.0640 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9340 -1.3840 -0.1290 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 15 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 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 17 31 1 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 22 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 M END