MDPI-ZINC03847479 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 -4.6340 -3.4200 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6820 -3.6940 1.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7800 -4.7590 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9200 -5.5420 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9740 -5.2600 1.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8730 -4.1970 2.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7280 -3.4130 2.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6700 -2.2600 3.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2240 -1.7950 3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0980 -6.0250 1.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0090 -6.5840 -0.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8880 -6.8130 -1.1560 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 -5.9610 -4.9770 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6900 -3.9760 2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2730 -1.4360 2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0650 -2.5790 4.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2040 -0.8590 4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6560 -2.5540 4.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0700 -6.7820 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0910 -7.6700 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7160 -5.9300 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 -7.0120 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6400 -1.5860 2.1450 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7830 -1.0580 2.2040 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