MDPI-ZINC04268240 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 68 0 0 1 0 0 0 0 0999 V2000 0.1970 1.4780 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -0.0290 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -0.6480 0.9260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -0.6830 -1.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -2.1330 -1.2210 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3270 -2.4660 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -2.6410 -1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -2.1380 -2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -2.4810 -3.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -2.1910 -3.6860 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1930 -1.0750 -3.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 -2.6950 -2.3910 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1460 -2.1660 -2.2720 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0020 -1.0590 -2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 -2.6320 -1.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1160 -3.0450 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -3.6800 -1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7600 -3.4240 -2.4920 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6050 -4.1110 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -3.5340 -3.6940 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3610 -3.5080 -4.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 -2.2160 -3.5170 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2720 -1.8500 -4.7920 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0550 -0.7780 -4.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -2.6250 -4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -2.1540 -5.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1430 -1.2220 -3.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1520 -0.0610 -3.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1920 -1.9690 -2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3220 -1.4620 -2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 -4.7180 -3.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 -1.4750 -0.3550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -1.5310 0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 -2.5110 1.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 -0.3720 1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -4.2170 -2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -3.9220 -4.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 -1.5660 -4.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 1.8430 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 1.8530 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 1.8280 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -2.2390 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -3.7220 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -1.0520 -2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 -2.5860 -2.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4780 -4.6720 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 -3.6820 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 -2.3670 -5.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -3.6900 -4.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 -1.9420 -6.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0270 -2.1060 -1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5300 -0.4070 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 -5.5310 -3.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4420 0.4130 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0500 -0.7080 2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4340 0.0170 2.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 -4.5240 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -4.6510 -3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3150 -4.5630 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -4.5910 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -4.1920 -5.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6850 -4.0100 -4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9680 -1.7650 -5.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3600 -1.7680 -5.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -0.5220 -4.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 8 45 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 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 32 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 29 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 31 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 54 1 0 0 0 0 35 55 1 0 0 0 0 35 56 1 0 0 0 0 36 57 1 0 0 0 0 36 58 1 0 0 0 0 36 59 1 0 0 0 0 37 60 1 0 0 0 0 37 61 1 0 0 0 0 37 62 1 0 0 0 0 38 63 1 0 0 0 0 38 64 1 0 0 0 0 38 65 1 0 0 0 0 M END