MDPI-ZINC03843494 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 0 0 0 0 0 0 0 0999 V2000 -2.9570 -0.8560 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5690 -1.1280 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -0.9170 1.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 -1.1740 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -1.6420 -0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 -1.8460 -1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -1.5970 -0.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -1.8080 -1.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -0.7440 -2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 -1.1900 -3.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 -1.5460 -3.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -2.3490 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 -2.6700 -2.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -1.7340 -3.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6970 -2.0270 -3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 -3.2890 -3.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 -4.2280 -2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -3.9180 -2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -4.8390 -1.8580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -5.7280 -2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -6.6500 -1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -7.3850 -1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 -5.5830 -2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5100 -3.5840 -3.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 -1.0240 -4.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7220 -1.3120 -4.4480 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 0.3670 -4.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -0.9550 1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -0.4570 2.9200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -1.3470 1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -0.4630 2.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 0.1790 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -1.5240 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 -1.0240 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 -1.8420 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1720 0.1130 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -0.4580 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6170 -1.8650 -4.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -3.2480 -2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -1.5810 -3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -0.7660 -3.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -5.1520 -3.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -6.3000 -3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -8.0420 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2530 -5.5510 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 -6.3240 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 -5.8540 -2.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 -3.3610 -2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0540 0.4650 -4.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 1.0950 -3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 0.5470 -5.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -1.6900 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 -0.4850 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 -2.1490 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -1.1640 3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 3 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 3 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 M END