IFLAB-ZINC04315602 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 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 -4.7660 -5.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7450 -5.0890 -6.3340 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4580 -5.9460 -7.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4200 -6.4370 -8.6750 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3790 -6.3820 -8.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7660 -7.0320 -9.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 -6.8770 -9.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 -6.2110 -8.3650 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 -7.7040 -10.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5990 -8.2600 -11.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -8.8870 -12.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 -8.9640 -13.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3640 -8.4140 -12.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7840 -7.7900 -10.9890 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 -2.5400 -4.1650 -6.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -5.7120 -5.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -7.2270 -10.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 -8.2000 -11.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 -9.3180 -13.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0280 -9.4550 -13.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4390 -8.4780 -12.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4050 -7.3660 -10.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 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 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 M END