CHEMBRIDGE-ZINC01104063 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 1.8830 1.3790 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -0.0840 0.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -0.7100 1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -0.0750 2.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -2.1820 1.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.8940 2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -4.2970 2.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -5.0340 1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -6.3440 1.3090 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1550 -6.5390 2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -5.2780 3.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -5.1740 4.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -6.3160 5.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -7.5620 4.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -7.6790 3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -7.4180 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -7.7900 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2520 -7.1470 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5640 -7.4880 -1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 -8.4730 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -9.1170 0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -8.7780 0.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -2.8650 0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -4.0790 0.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -2.1090 0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -0.7710 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6040 -0.1480 -0.6220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 1.7800 1.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 1.6980 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 1.7480 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -2.3740 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -4.6200 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 -4.2040 5.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -6.2380 6.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -8.4500 5.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -8.6550 3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -7.0780 -0.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -8.2880 0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -6.3770 -1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1010 -6.9850 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2140 -8.7390 -0.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9890 -9.8860 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 -9.2840 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5750 -2.5440 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 M END