MDPI-ZINC03845673 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 43 0 0 1 0 0 0 0 0999 V2000 -0.0540 1.5190 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -0.0030 -0.0550 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9010 -0.4590 -0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 -0.3770 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 0.0180 -2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -0.3560 -3.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 0.0340 -5.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 1.1850 -5.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -0.9020 -5.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -0.5090 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -2.0390 1.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2990 -2.3910 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -2.5250 2.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -2.9120 3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 -3.3850 4.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 -4.7550 4.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0550 -5.2040 5.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6530 -4.2990 6.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 -2.9390 6.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4770 5.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -2.5340 1.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 1.9710 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8880 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 1.7820 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 0.1500 -1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -1.4520 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -0.5080 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 1.0940 -2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7680 0.1710 -3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -1.4310 -3.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3550 1.4640 -6.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 1.8560 -5.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -0.6880 -5.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -0.7630 -6.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -1.9320 -5.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 -0.1320 1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -0.1570 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8240 -5.4630 3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 -6.2640 5.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -4.6560 7.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9580 -2.2380 6.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6090 -1.4160 4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -2.2590 2.1050 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 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 3 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 M END