MDPI-ZINC04293070 MOE2007 3D CORINA 3.40 0006 02.08.2006 73 76 0 0 1 0 0 0 0 0999 V2000 -0.4380 1.3700 1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -0.1420 1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6810 -0.6300 1.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -1.9460 1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 -2.6680 1.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1230 -2.5250 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9800 -4.0350 0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3280 -4.6220 0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6760 -4.1190 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3470 -4.4200 1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -6.1150 -0.2670 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6710 -6.6190 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5460 -6.7620 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3880 -7.5340 -1.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -7.7230 -1.9800 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5890 -8.4270 -1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3730 -6.3170 -1.5760 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8770 -6.2960 -1.4280 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5370 -5.2480 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 -6.9690 -2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 -7.3500 -3.7350 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5150 -6.4400 -4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 -8.2240 -3.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8370 -9.2300 -3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 -8.4100 -4.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3650 -8.0860 -4.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -9.0520 -5.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 -8.2580 -6.0550 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6950 -7.2640 -6.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -8.0620 -4.8880 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8520 -9.4150 -4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 -10.0920 -5.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9950 -10.2550 -6.8120 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3580 -10.5870 -7.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -8.9540 -7.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9640 -11.2780 -6.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -7.1700 -5.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -6.9520 -0.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8450 -5.2260 -2.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 1.7360 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 1.8610 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 1.5900 2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -0.3630 0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -0.6330 2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 -2.3320 1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -2.0620 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2400 -4.2280 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 -4.4980 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 -4.9230 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4610 -3.3550 1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3070 -4.8390 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8090 -7.4560 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 -5.9930 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8860 -8.5040 -1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7790 -6.9570 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 -6.2820 -2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -7.8720 -2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 -10.0770 -5.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3340 -9.0440 -6.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -9.2750 -3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -10.0580 -4.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -9.5330 -5.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -11.0900 -5.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -9.1750 -7.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 -8.2850 -7.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -12.1480 -6.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -7.0080 -4.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -7.6570 -6.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6280 -6.2110 -5.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -6.9720 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 -4.2530 -2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4240 -5.4060 -3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9330 -5.2420 -2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 43 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 49 1 0 0 0 0 10 50 1 0 0 0 0 10 51 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 52 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 54 1 0 0 0 0 14 55 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 38 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 30 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 35 1 0 0 0 0 30 31 1 0 0 0 0 30 37 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 32 33 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 35 64 1 0 0 0 0 35 65 1 0 0 0 0 36 66 1 0 0 0 0 37 67 1 0 0 0 0 37 68 1 0 0 0 0 37 69 1 0 0 0 0 38 70 1 0 0 0 0 39 71 1 0 0 0 0 39 72 1 0 0 0 0 39 73 1 0 0 0 0 M END