IFLAB-ZINC04340314 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 0.4370 1.4380 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -0.0170 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.4270 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -1.7890 -1.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -2.7780 -0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -2.3530 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -0.9940 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -4.1600 -0.6470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -4.8180 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -4.3360 -2.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -5.4300 -3.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -5.5060 -4.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -4.5420 -5.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -6.8210 -5.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 -6.9470 -6.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -7.9200 -4.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -7.8690 -3.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -6.5990 -2.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -6.2100 -1.7980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 -7.1380 -0.7790 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4900 -7.8060 -0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6450 -7.8940 -1.2090 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8870 -7.6290 -2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -7.2430 -0.3190 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1700 -6.3970 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 -6.7260 0.8960 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4190 -5.7960 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -6.3880 0.4410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 -7.6850 2.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -7.0360 3.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 -6.7140 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 -8.1830 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -9.0170 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -9.1850 -0.8790 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7490 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 1.6360 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 2.0510 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 0.3090 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4540 -2.0580 -2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -3.0840 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -0.7110 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -4.7550 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -8.8830 -5.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -8.6030 1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -7.9430 2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 18 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 34 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 32 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 M CHG 1 34 -1 M END