MDPI-ZINC03850724 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.7760 1.6710 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 0.1640 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 -0.5160 0.9910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -1.8940 1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.6260 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -4.0350 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -4.7430 -1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -4.0710 -2.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -2.6740 -2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -1.9380 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.5280 -1.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 0.1420 -2.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -2.0370 -3.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -4.8380 -3.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4290 -4.3040 -4.8500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -6.3170 -3.6590 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2300 -6.8150 -4.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -6.8830 -2.5330 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9140 -6.6590 -2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -6.2460 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -8.3990 -2.4510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3820 -8.6260 -2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -9.0380 -3.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0390 -8.4910 -4.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -10.3600 -4.1730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4510 -11.0000 -3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7080 -10.1260 -4.8990 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5410 -9.4860 -5.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -11.4670 -5.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -9.4930 -4.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 -10.9920 -5.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -8.9120 -1.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -10.0780 -0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -6.5090 -3.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 0.1880 2.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 2.0090 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 2.0390 -1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 2.0550 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 -2.4080 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -4.5580 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 0.3150 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -1.8290 -4.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -6.5850 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -6.5580 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -12.1070 -4.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -11.3010 -5.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -11.9500 -6.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -9.9780 -3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7380 -10.4760 -5.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 -10.4050 0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -9.8470 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -10.8730 -1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9960 -6.0830 -3.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 0.4140 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 16 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 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 32 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 30 48 1 0 0 0 0 31 49 1 0 0 0 0 32 33 1 0 0 0 0 33 50 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 34 53 1 0 0 0 0 35 54 1 0 0 0 0 M END