MDPI-ZINC03844229 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 -0.3510 0.9870 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 0.9850 2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 1.4400 3.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 2.9610 3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 3.4840 2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 3.0180 1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 3.6280 3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 4.1720 4.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 4.8150 4.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 6.0900 3.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1510 6.7170 3.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1690 6.0650 4.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9600 4.7930 5.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 4.1670 4.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6930 6.8350 4.7120 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.2430 4.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -0.1050 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 1.3550 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 1.3450 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 1.3460 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -0.1080 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 0.9600 3.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 1.0780 4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 3.1490 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 4.5810 2.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 3.3060 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 3.4170 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 6.6050 3.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 7.7100 3.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 4.2860 5.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 3.1760 5.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 4.1990 4.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 1.5110 1.1390 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8470 1.1390 1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 6 33 1 0 0 0 0 7 8 3 0 0 0 0 8 9 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 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 15 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 16 32 1 0 0 0 0 33 34 1 0 0 0 0 M CHG 1 33 1 M END