MDPI-ZINC03843408 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 0.9560 -0.4010 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 0.0210 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 1.5490 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -0.5320 -0.0700 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3430 -1.6200 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 0.0340 -1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -0.7220 -2.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6310 -1.7080 -2.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -0.1330 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -1.0520 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -0.6860 3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0150 0.6000 3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6690 1.5200 2.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 1.1540 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 -0.5220 1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 0.2370 2.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -0.0920 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -1.4840 -1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 0.0720 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.9370 -0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 1.8500 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 1.9470 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 -0.0700 -1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6450 1.0880 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 -2.0570 1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 -1.4040 3.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6790 0.8860 3.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 2.5240 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 1.8740 0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4860 -0.2990 -3.8010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 -1.8470 1.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8250 -2.1470 2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -0.8170 -4.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 15 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 M END