MDPI-ZINC03843985 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 0.0860 1.6750 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 0.1400 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8140 -0.3520 1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 0.1690 2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -0.2820 2.5400 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7960 0.2120 3.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 0.1120 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -0.3390 0.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8990 0.1300 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -1.8510 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 -2.3110 -1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.9060 -1.3180 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0040 -2.2680 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -0.3780 -1.2940 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1740 0.0390 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 0.0420 -1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7330 -0.2930 -2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -1.4810 -3.4160 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5850 -2.4910 -2.3380 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4850 -2.8620 -1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -3.6540 -3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0090 -3.6980 -4.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -2.3890 -4.3520 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2340 -2.6700 -3.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 -3.5610 -4.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1450 -3.1900 -5.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 -1.8020 -5.6510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 -1.0060 -4.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -1.6920 2.7540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 2.0300 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 2.0210 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 2.0640 0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -1.4430 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 0.0040 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -0.2380 3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 1.2530 2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0770 -0.3520 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 1.1960 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -2.3550 0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 -2.1320 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -3.3920 -1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -1.8230 -2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 1.1160 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -0.4880 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 0.5830 -3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -0.4460 -2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -4.5880 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -3.4740 -3.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6690 -4.5610 -4.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -3.7420 -5.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 -1.7310 -3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1520 -3.1670 -2.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5510 -4.5050 -5.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6790 -3.8290 -5.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5730 -2.2460 -4.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4150 -2.3240 -6.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 -0.2650 -4.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -1.8560 -4.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -0.5600 -3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -1.9860 3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 29 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 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 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 43 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 23 1 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 60 1 0 0 0 0 M END