MDPI-ZINC04267251 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 -0.2540 1.4390 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -0.0180 0.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -0.7760 1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -0.1580 2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -0.9200 3.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -2.3030 3.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -2.9310 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.1760 1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -2.8340 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -2.0340 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 -0.5830 -0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1970 0.1240 -1.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -2.6410 -2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -3.8520 -2.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -1.7850 -3.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -2.3270 -4.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -1.4510 -5.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -1.9570 -6.8770 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1130 -2.0100 -6.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -1.0120 -8.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 -0.0750 -8.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 0.7920 -9.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6220 0.7220 -10.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.2150 -10.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -1.0850 -9.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -3.2900 -7.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -4.1700 -7.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1670 -3.7820 -7.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1610 -4.6540 -8.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 -5.9130 -8.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -6.3030 -8.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -5.4370 -8.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -5.9290 -8.3290 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.8260 -4.1700 -8.0300 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -4.1760 0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 1.8740 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 1.8290 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 1.6970 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 0.9170 2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -0.4370 4.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -2.8860 4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -4.0070 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -0.7180 -3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -3.3940 -4.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 -1.4830 -6.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -0.4260 -5.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -0.0210 -7.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 1.5240 -9.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 1.4000 -11.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -0.2690 -11.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -1.8200 -9.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -3.5630 -7.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 -2.7990 -7.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 -6.5930 -8.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -7.2860 -9.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -4.5100 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 11 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 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 26 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 34 1 0 0 0 0 30 31 2 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 33 1 0 0 0 0 35 56 1 0 0 0 0 M END