MDPI-ZINC03847480 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.0240 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1010 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -2.6290 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4190 -2.8750 1.4810 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4200 -1.9280 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8100 -3.4530 1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7500 -2.9170 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0410 -3.4130 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3970 -4.4570 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4560 -4.9890 2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1620 -4.4890 2.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1700 -5.1080 3.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9670 -4.1820 3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6640 -4.9500 1.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9580 -2.8840 -0.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5200 -1.8160 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.6010 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7220 -2.0080 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8930 -3.5830 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4730 -2.1080 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7300 -5.7980 2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6480 -5.2690 4.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8350 -6.0650 2.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2680 -3.2910 4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 -4.7030 4.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7940 -5.6780 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3480 -1.4860 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1790 -0.9840 -0.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7010 -2.1620 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 -3.7970 2.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3170 -4.6100 1.5460 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 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 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 42 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 42 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 42 43 1 0 0 0 0 M END