MDPI-ZINC03847053 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 40 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.8100 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1040 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 -2.1290 -0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7850 -1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.4920 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -1.5260 -3.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -2.8280 -2.9760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -3.2030 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -4.4580 -1.3460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -5.4010 -2.3860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -6.5940 -2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -7.6250 -3.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -7.4330 -4.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -6.1730 -4.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -6.2900 -5.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -7.5550 -6.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -8.2520 -5.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -9.6540 -5.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -5.0720 -3.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -3.8300 -3.9040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.4620 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.9640 1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 0.5300 -2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -1.3050 -4.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -6.7280 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 -8.5690 -2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -5.5110 -6.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -7.9580 -7.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 -10.2950 -4.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -9.9080 -6.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -9.8000 -4.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 M END