MDPI-ZINC03844922 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4300 -2.1100 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -3.9600 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 -4.4290 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -5.5380 -1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -5.9680 -2.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -5.2930 -3.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 -4.1730 -3.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 -3.7400 -2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -2.6120 -2.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -1.9700 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 -1.0010 -1.1230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -5.7510 -5.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -6.9730 -5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -7.3090 -6.3150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -7.9280 -4.0730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3290 -8.6580 -4.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -7.1590 -2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 -8.6410 -3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -8.5390 -2.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -9.3910 -4.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -10.0490 -4.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 -10.8510 -5.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -4.2790 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7780 -4.3910 0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2100 -6.0700 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -3.6400 -4.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0170 -2.2910 -3.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1840 -5.1810 -5.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -6.8190 -2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -7.8130 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 -10.7210 -3.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2960 -9.3000 -4.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9650 -10.1790 -6.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 -11.6000 -6.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 -11.3450 -5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 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 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 28 44 1 0 0 0 0 28 45 1 0 0 0 0 28 46 1 0 0 0 0 M END