MDPI-ZINC03845543 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.6070 1.2350 0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -0.2490 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 -1.0700 1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -2.4400 1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -2.9640 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -4.3310 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -4.8190 -1.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -6.1960 -1.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -6.6110 -3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -5.6690 -4.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -4.3940 -3.8670 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -3.9040 -2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -2.5310 -2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 -2.0410 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3480 -0.7290 -0.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -1.6580 -3.4820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -6.1500 -5.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -8.0410 -3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -8.4200 -4.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -0.4730 2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 0.7340 2.9640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 1.7020 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 1.6600 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 1.4150 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 -3.0840 2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1700 -5.0080 0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 -6.9050 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -2.0000 -4.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -0.7080 -3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -6.5160 -5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -5.3260 -6.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -6.9560 -5.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -8.9260 -2.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -1.2670 3.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -0.8300 4.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -9.8520 -2.6320 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 15 2 0 0 0 0 3 4 2 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 2 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 M END