MDPI-ZINC03845067 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 1 0 0 0 0 0999 V2000 -1.8100 -0.8340 -0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 0.0560 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -0.2710 0.8240 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0970 0.3350 0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -1.7540 0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -2.0800 2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -3.5630 2.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -3.8660 0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8380 -3.5400 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -2.0570 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -5.2510 0.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 -5.5280 0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 0.0280 2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4530 -0.8120 2.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 1.2290 2.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 1.5510 3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 0.6000 4.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 0.9110 5.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2820 2.1600 5.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 3.1600 4.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 2.8560 3.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 3.8570 2.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 5.1060 2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 5.4060 3.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 4.4580 4.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -0.7160 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 -0.5440 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -1.8750 -0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -0.1250 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 1.1020 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -2.3600 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -1.4740 2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7020 -1.8640 2.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 -3.7960 3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -4.1690 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 -3.2600 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -3.7560 -1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9340 -4.1460 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -1.8240 -1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 -1.4510 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 -6.5990 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2200 -5.2010 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 -4.9940 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 1.8690 2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -0.3990 4.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 0.1490 6.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 2.3820 6.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 3.6380 2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 5.8740 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4920 6.4050 4.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1520 4.7050 5.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 13 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 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 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 M END