MDPI-ZINC03845872 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 41 0 0 1 0 0 0 0 0999 V2000 1.4130 -0.0870 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -0.0510 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -0.6730 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -0.8440 1.5870 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1080 -1.8990 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -0.6730 2.8400 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8610 -1.3960 3.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 -1.5680 5.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -2.3220 4.7180 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0580 -2.3630 5.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -1.6070 3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 -1.1970 2.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 -0.4170 4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0160 -2.5940 2.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -3.7330 4.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -3.9330 3.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 0.8280 3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 -0.3590 1.8630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -1.1230 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9470 0.4010 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 0.4340 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 0.9820 0.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -1.7510 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -0.4670 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -0.2450 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -2.3620 3.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -0.7970 4.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -2.1420 5.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -0.5960 5.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 0.2750 4.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 0.0950 3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -0.7750 4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 -2.8640 3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -2.1250 2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 -3.4920 2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 1.3370 2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 0.9800 4.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 1.2320 3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.5760 2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -4.7680 4.9540 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 -5.6560 4.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 40 41 1 0 0 0 0 M END