IFLAB-ZINC05258835 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 0 0 1 0 0 0 0 0999 V2000 -0.0340 1.5290 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 0.0000 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -0.5340 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -2.0630 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 -2.5960 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 -4.1260 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 -6.1070 0.0080 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3900 -6.4730 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5410 -6.5970 -0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6190 -6.1830 -2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 -5.5580 -2.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7000 -6.5080 -2.7750 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8180 -6.0410 -4.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6900 -5.9040 -4.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8570 -5.4380 -6.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1280 -5.1270 -6.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1770 -5.2680 -5.8470 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0620 -5.7140 -4.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0870 -6.6240 1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 -5.8490 2.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 1.9090 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5630 1.8930 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 1.8760 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -0.3470 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -0.3640 0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -0.1870 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9730 -0.1700 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 -2.4090 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 -2.4270 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3620 -2.2500 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -2.2320 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3190 -4.4720 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2990 -4.4900 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5900 -7.6830 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3740 -6.1580 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3970 -7.0660 -2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7090 -6.1540 -4.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0050 -5.3180 -6.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2650 -4.7630 -7.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9440 -5.8210 -3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2050 -4.6380 0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7190 -4.2780 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 -7.9460 1.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9890 -8.2300 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 7 41 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 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 36 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 41 42 1 0 0 0 0 43 44 1 0 0 0 0 M END