MDPI-ZINC03845799 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 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 1.2040 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0340 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4290 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -0.6850 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -1.9000 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 0.0080 -0.0440 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1320 -0.7040 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2790 0.3090 -0.0650 C 0 0 3 0 0 0 0 0 0 0 0 0 7.2540 0.8790 -0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5940 -0.4210 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0240 -1.1450 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2140 -1.8420 -1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9820 -1.8210 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5580 -1.1000 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3630 -0.3910 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9780 0.3960 2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4820 0.7070 2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1290 1.2220 1.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7030 2.4300 0.9130 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5880 3.1670 1.8750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 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 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9880 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 0.9780 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2080 -1.3340 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1920 -1.3250 -0.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4220 -1.1620 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5430 -2.4020 -1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9120 -2.3690 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1600 -1.0850 2.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2230 -0.1830 3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5390 1.3310 2.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9160 -0.2010 2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2610 1.4600 3.1620 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 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 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 M END