IBS-ZINC02108229 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 1 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 -0.0340 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -0.8220 -2.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.9980 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4880 -2.4800 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -2.6770 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -2.0740 2.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -4.0250 1.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -4.7620 2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -6.2650 2.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -7.0360 3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -8.5160 3.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -9.1780 2.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -10.5360 2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -11.2320 2.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 -10.5700 2.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -9.2130 3.1520 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -4.5060 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -4.4890 2.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9750 -4.5140 3.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -6.5390 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -6.5140 1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -6.7620 3.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 -6.7870 4.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 -8.6350 2.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -11.0530 2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -12.2930 2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 -11.1140 2.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 -8.6960 3.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 1.2850 -1.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 1.5570 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 41 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 41 42 1 0 0 0 0 M END