IFLAB-ZINC04941862 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7040 -0.4850 1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.8150 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 -2.5530 0.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -2.3880 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5080 -3.8510 2.4450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 -4.6010 3.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -6.0100 3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 -6.7140 4.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -6.0340 5.4150 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 -4.7190 5.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 -4.0120 4.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 -8.0410 4.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -8.1040 2.9230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -6.9100 2.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -9.1740 4.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -2.0380 2.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -2.0640 3.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.2930 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7540 -4.1980 6.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -9.4710 5.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -10.0120 4.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9660 -8.8840 5.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 M END