IFLAB-ZINC04160022 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4620 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 -1.0390 -0.6340 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -0.6460 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.6150 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 0.0600 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -0.5280 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 1.4040 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 2.1100 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 2.1400 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3990 1.4660 -0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5080 3.2850 -1.0340 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6720 3.9370 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8130 4.0850 -0.9940 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7410 4.9350 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0470 4.5880 0.4340 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2420 5.2670 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 3.3930 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 2.6740 1.2810 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2970 5.2770 0.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 3.2480 -1.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3150 2.7500 -2.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 1.9960 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 2.7360 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1910 3.7490 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5100 5.6230 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7600 3.6910 -1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 3.4200 -3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 19 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 18 25 1 0 0 0 0 20 26 1 0 0 0 0 21 27 1 0 0 0 0 22 28 1 0 0 0 0 M END