MDPI-ZINC03846283 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 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 3 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.5700 1.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1830 -2.2190 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4350 -2.4410 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7330 -2.5320 -1.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4890 -2.7390 -2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 -2.5360 -2.2370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -3.2250 -3.5570 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3750 -4.1890 -3.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 -3.3780 -4.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2820 -3.8720 -5.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 -4.3910 -4.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -2.2280 -4.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -1.0700 -3.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -2.6760 -4.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -4.1000 1.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -4.6070 2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -4.6300 1.2460 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 -2.4150 -4.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -3.9810 -6.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 -3.1510 -6.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8040 -4.8360 -5.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -4.0390 -3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 -4.5000 -4.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -5.3540 -3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -2.5870 -5.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 -2.0490 -4.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -3.7140 -4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -4.4520 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -4.2560 3.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -5.6970 2.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 -4.2300 2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6140 -4.2690 0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -5.7200 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 -4.2780 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 22 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 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 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 24 49 1 0 0 0 0 24 50 1 0 0 0 0 M END