IFLAB-ZINC04138105 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.8180 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -3.0870 -2.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3270 -2.7090 -2.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 -3.7460 -4.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0360 -4.0080 -4.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 -4.7540 -5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -6.1430 -5.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0200 -6.8440 -6.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0410 -6.1570 -8.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 -4.7500 -8.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0650 -4.0600 -6.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -4.3390 -9.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 -5.4610 -10.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -6.5570 -9.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 -7.4790 -9.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -5.5070 -11.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8480 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.2170 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.7630 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -4.0480 -4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -4.6080 -3.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -3.0620 -4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 -6.6780 -4.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0030 -7.9240 -6.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -2.9800 -6.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 -3.3260 -9.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -5.5030 -12.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -6.4150 -12.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 -4.6360 -12.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 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 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END