MDPI-ZINC03847202 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 0.1580 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -0.4520 -3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 -1.8270 -3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 -2.6010 -2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -1.9960 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -2.7550 -0.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 -4.1730 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -2.5180 -4.3460 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1290 -3.4950 -4.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -1.6160 -5.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 0.4220 -4.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 -0.3980 -5.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9260 -1.6540 -4.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 -2.6490 -3.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4180 -3.7870 -3.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7360 -3.9300 -2.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6530 -2.9220 -3.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2460 -1.7910 -3.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9470 -3.0490 -2.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1300 -5.0470 -2.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1310 -6.0380 -1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 1.2360 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -3.6780 -2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -4.6580 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 -4.4840 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -4.4610 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -2.0660 -6.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 -1.4750 -5.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 0.9230 -4.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 1.1760 -3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8190 0.4850 -4.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0200 -0.3980 -5.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 -4.5650 -3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9600 -1.0110 -4.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5180 -3.4800 -3.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3340 -5.6030 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7210 -6.3910 -2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5780 -6.8740 -1.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 -0.3270 -5.2330 N 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 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 33 1 0 0 0 0 13 34 1 0 0 0 0 13 45 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 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 23 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END