MDPI-ZINC03845081 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -1.0350 1.3890 -1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -0.0960 -0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 -0.5250 -0.0660 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1320 -2.0470 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 -2.6970 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -4.2190 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 -4.6630 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -4.0140 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -2.4910 0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 0.1250 1.3180 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1680 -0.2300 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 1.6220 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 2.3140 1.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 3.6870 1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8560 4.3720 0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9540 3.6750 0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0130 2.3020 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 5.7220 0.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8910 6.3610 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2210 -0.2240 2.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 -0.1090 -0.7250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 1.5920 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 1.6490 -1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 1.9850 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 -0.6820 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.2640 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2840 -2.3530 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8710 -2.3910 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -2.3810 -1.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -4.6820 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -4.5250 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1740 -4.3570 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -5.7480 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3630 -4.3300 1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -4.3190 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 -2.0280 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2810 -2.1850 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 1.7810 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 4.2270 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 4.2060 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 1.7590 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 7.4360 0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9890 5.9690 -0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 6.1650 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0510 0.0620 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 -0.3480 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 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 36 1 0 0 0 0 9 37 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 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 M END