MDPI-ZINC03845136 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 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 -0.0210 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 3.6200 -0.6490 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 0.0690 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0420 -0.6110 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2340 0.1030 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4400 -0.5660 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4620 -1.9600 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2640 -2.6740 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0610 -2.0010 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7570 -2.6820 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7790 -4.0760 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9840 -4.7460 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1770 -4.0320 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1570 -2.6420 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9540 -1.9680 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3960 -4.7120 -0.1480 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 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3030 1.9760 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 3.1690 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -1.6190 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8080 1.0390 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2170 1.1830 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3660 -0.0110 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2790 -3.7540 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 -2.5530 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8520 -4.6310 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0020 -5.8260 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0850 -2.0890 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9400 -0.8880 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4100 -5.6820 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2290 -4.2140 -0.1540 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 7 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 M END