MDPI-ZINC03846609 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 -0.0530 1.3660 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -0.0940 0.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -0.7070 1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 0.0570 2.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -0.5620 3.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -1.9430 3.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -2.7130 2.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -2.1060 1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -2.9170 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -2.2590 -0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -0.7980 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -0.2150 -1.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 -2.9960 -2.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -4.1930 -2.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -2.2930 -3.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -3.3100 -4.5650 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9870 -3.8500 -4.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -2.5900 -5.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 -2.4230 -6.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -1.7640 -7.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 -1.2680 -8.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -1.4360 -7.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -2.0920 -6.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -0.6000 -9.5250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -0.4240 -10.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 -0.0780 -9.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -4.2570 -4.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -5.5110 -5.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -6.4580 -4.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -7.6860 -5.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -7.9320 -6.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -7.0150 -6.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -5.8340 -5.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -4.2600 0.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 1.6540 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 1.7240 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 1.8060 1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 1.1320 2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 0.0340 4.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -2.4120 4.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -3.7870 2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 -1.5310 -3.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -1.8220 -3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -2.8090 -6.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 -1.6340 -8.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 -1.0520 -7.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -2.2200 -5.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 0.5120 -10.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4470 -0.3970 -11.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -1.2540 -10.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -0.8400 -10.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 0.8050 -10.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 0.1900 -9.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -4.0140 -3.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -6.2380 -4.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6410 -8.4440 -5.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -8.8890 -6.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -5.1100 -6.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -4.7350 -0.4520 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 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 38 1 0 0 0 0 5 6 1 0 0 0 0 5 39 1 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 34 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 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 27 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 33 58 1 0 0 0 0 34 59 1 0 0 0 0 M END