MDPI-ZINC03844721 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2040 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0340 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4300 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -0.6840 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -1.8980 -0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8500 0.0090 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0810 -0.7620 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2790 0.1890 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5560 -0.6110 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1300 -0.9720 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3020 -1.7060 -1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8980 -2.0780 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3240 -1.7160 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1550 -0.9780 1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1750 -2.8790 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3740 -1.9280 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6030 -2.7000 -0.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7590 -2.0090 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7410 -0.7940 -0.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0500 -2.7270 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2500 -2.0140 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4520 -2.6910 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4700 -4.0740 -0.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2840 -4.7880 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0750 -4.1230 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 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 1.2170 -1.7600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9890 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1240 -1.3950 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1080 -1.3860 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2360 0.8220 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2520 0.8140 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6640 -0.6810 -2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7500 -1.9890 -2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7900 -2.0070 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7090 -0.6920 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2180 -3.5110 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2010 -3.5040 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3300 -1.2960 -1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3480 -1.3040 0.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2380 -0.9340 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3810 -2.1400 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.4130 -4.6000 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3050 -5.8680 -0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1510 -4.6820 -0.1590 H 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 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 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 M END