MDPI-ZINC03845549 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 50 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4270 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.6880 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6650 -0.3460 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8850 -1.0580 -0.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9020 -0.7640 -1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0940 -1.4860 -1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1450 -1.2120 -2.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2990 -1.9630 -2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4060 -2.9730 -1.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4320 -3.2340 -0.7780 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2770 -2.5480 -0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2570 -2.8400 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 -2.1200 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 -1.7200 0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 -2.0380 1.8160 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5730 -3.7120 -1.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4280 -1.7110 -3.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7180 -1.5390 -3.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7650 -1.3050 -3.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5370 -1.2400 -5.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2590 -1.4090 -5.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2050 -1.6500 -4.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9850 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4940 0.4430 -1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7690 0.0190 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0480 -0.4370 -3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3910 -3.6220 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 -1.5560 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 -2.7440 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3020 -3.5330 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6630 -4.4080 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8980 -1.5890 -1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7650 -1.1710 -3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3600 -1.0570 -5.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0860 -1.3570 -6.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2080 -1.7860 -5.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0720 -2.3900 0.9190 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 2 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 46 2 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 45 1 0 0 0 0 M END