MDPI-ZINC04204368 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 49 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0200 -0.6140 1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6690 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.1190 -1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.6960 -2.5130 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8380 -2.2990 -3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -4.2210 -2.4420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7630 -4.6180 -1.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -4.7980 -3.8590 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8640 -4.5970 -4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -6.3100 -3.7930 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5200 -6.7840 -3.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -6.8600 -5.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -7.3430 -5.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -6.5820 -3.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -7.7390 -2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -8.4980 -2.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -8.0900 -1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -4.1800 -4.6290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -4.0620 -5.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.4610 -6.4500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 -3.4300 -6.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -4.5910 -1.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -4.7370 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -4.5620 0.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -5.1200 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -2.3260 -3.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -1.1740 -3.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 -0.4970 -3.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4770 -0.7250 -4.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -2.4460 -0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -2.4700 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 -7.2910 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -9.0210 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 -8.2140 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -2.3560 -6.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -3.8640 -7.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0070 -3.6150 -6.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 -5.2340 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -6.0620 0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -4.3410 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -1.1200 -5.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 0.3640 -4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 -1.0940 -4.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -6.8120 -6.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -7.1780 -6.9150 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 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 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 28 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 49 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 49 50 1 0 0 0 0 M END