MDPI-ZINC03847948 MOE2007 3D CORINA 3.40 0006 02.08.2006 74 77 0 0 1 0 0 0 0 0999 V2000 -0.2000 1.5300 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 0.0290 -0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -0.2080 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 -0.5240 -0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4800 -2.0440 -0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -2.5970 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 -4.1170 -0.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1860 -4.3650 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -4.7440 -1.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2390 -4.6600 0.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9220 -4.3250 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2110 -6.2010 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7050 -6.5970 1.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5660 -5.3790 1.9310 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6910 -5.3360 3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7390 -4.1970 1.3910 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5230 -2.9070 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8220 -3.0920 0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6600 -4.1670 1.2360 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.8160 -3.8800 2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9040 -5.4970 1.2000 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.5040 -6.2800 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6520 -5.8600 -0.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9660 -5.8990 -0.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0050 -5.2140 -0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0060 -4.3080 0.5470 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.5240 -2.9310 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8690 -3.0920 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6840 -3.9160 -1.8650 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.9360 -3.4410 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2780 -5.3260 -1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9260 -3.9930 -2.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0010 -4.8910 1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5350 -3.9740 2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 1.9240 -1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 1.6990 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 2.0370 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -0.4780 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 0.2990 1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -1.2770 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6850 0.1860 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -0.0820 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -0.2770 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -2.4860 -1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -2.2910 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 -2.1550 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 -2.3500 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -4.3570 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2270 -5.8270 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 -4.4960 -2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8750 -6.6150 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 -6.5630 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3150 -7.5000 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 -6.7400 2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7610 -2.5760 2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9160 -2.1460 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3750 -2.1520 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5950 -3.4090 -0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0060 -5.1090 -0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1740 -6.8380 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0510 -6.5250 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6520 -2.3020 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8080 -2.4660 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5700 -3.6010 0.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2630 -2.1090 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0770 -5.8880 -2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0480 -5.8320 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8820 -4.5030 -3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0880 -4.2220 2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9760 -5.0000 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6500 -5.8670 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 -3.1340 1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 -3.7580 3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9170 -4.8720 2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 38 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 44 1 0 0 0 0 5 45 1 0 0 0 0 6 7 1 0 0 0 0 6 46 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 48 1 0 0 0 0 9 49 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 51 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 53 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 19 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 24 25 2 0 0 0 0 24 61 1 0 0 0 0 25 26 1 0 0 0 0 25 31 1 0 0 0 0 26 27 1 0 0 0 0 26 33 1 0 0 0 0 27 28 1 0 0 0 0 27 62 1 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 32 68 1 0 0 0 0 33 69 1 0 0 0 0 33 70 1 0 0 0 0 33 71 1 0 0 0 0 34 72 1 0 0 0 0 34 73 1 0 0 0 0 34 74 1 0 0 0 0 M END