%chk=000058513.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058513

0 1
 O  -0.4913000     -8.8000000E-02 -0.4725000    
 O    2.268900       1.715300      -1.611200    
 O  -0.4208000       1.866300      -1.681800    
 N   -3.822900      0.5247000      0.4889000    
 C   -2.429800      -1.551200     -0.2200000    
 C   -1.862100     -0.2637000     -0.8444000    
 C   -3.886900      -1.682900     -0.6856000    
 C   -2.446100      -1.391200       1.310400    
 C   -2.682200      0.9446000     -0.3576000    
 C   -4.666100     -0.4226000     -0.2736000    
 C   -3.293300     -0.1648000       1.685500    
 C    1.579100       1.108500     -0.5102000    
 C    1.773400       2.032700      0.7479000    
 C   0.1182000       1.030700     -0.9642000    
 C    3.275600       2.196800       1.082700    
 C    1.218800       3.452800      0.4695000    
 C    1.064600       1.488200       2.006600    
 C    2.131600     -0.2485000     -0.3111000    
 C    2.577000      -1.352200     -0.1475000    
 C    3.113800      -2.660500      4.0700000E-02
 C    4.602400      -2.844400      1.0300000E-02
 C    2.277700      -3.690700      0.2374000    
 H   -1.832900      -2.425200     -0.5007000    
 H   -1.914200     -0.3473000      -1.938300    
 H   -4.347000      -2.571500     -0.2373000    
 H   -3.927100      -1.809000      -1.774000    
 H   -1.425700      -1.274700       1.694000    
 H   -2.865400      -2.290600       1.777000    
 H   -2.088200       1.665900      0.2160000    
 H   -3.073800       1.496500      -1.221800    
 H   -5.540600     -0.7044000      0.3259000    
 H   -5.069500      7.5800002E-02  -1.164000    
 H   -2.694400      0.5345000       2.282300    
 H   -4.123500     -0.4679000       2.335600    
 H    3.417500       2.875600       1.931900    
 H    3.834900       2.612800      0.2377000    
 H    3.737000       1.241600       1.354900    
 H    1.722500       3.941900     -0.3699000    
 H   0.1427000       3.441700      0.2715000    
 H    1.367400       4.100900       1.342300    
 H    1.442300      0.4995000       2.287400    
 H    1.219400       2.151500       2.865600    
 H  -1.6000001E-02   1.404000       1.852000    
 H    1.802100       2.526700      -1.870200    
 H    5.077000      -2.246600      0.7959000    
 H    4.892600      -3.889000      0.1660000    
 H    5.006700      -2.527400     -0.9570000    
 H    2.651400      -4.699100      0.3832000    
 H    1.200100      -3.556600      0.2586000    


%chk=000058513-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000058513

0 1
O -0.560472 0.122619 -0.216602
O 2.508552 1.822766 -1.316976
O 0.019358 1.369456 -2.088785
N -4.057081 0.742522 0.156934
C -2.514355 -1.345218 -0.053713
C -1.915265 -0.155481 -0.827110
C -3.903972 -1.642075 -0.690052
C -2.708968 -0.975097 1.442267
C -2.873833 1.077062 -0.679985
C -4.817670 -0.375013 -0.484046
C -3.601328 0.317168 1.517766
C 1.725505 1.049356 -0.337571
C 1.712824 1.884545 1.022126
C 0.302893 0.876559 -0.964420
C 3.190035 2.196643 1.382347
C 0.946140 3.210323 0.785801
C 1.068998 1.089278 2.185484
C 2.326198 -0.290583 -0.175274
C 2.843536 -1.407890 -0.057285
C 3.494303 -2.689363 0.022352
C 4.640149 -2.918992 -0.955682
C 3.101348 -3.637235 0.926019
H -1.849198 -2.220677 -0.149975
H -1.736145 -0.405872 -1.888491
H -4.340231 -2.533434 -0.202638
H -3.791667 -1.881540 -1.765133
H -1.727789 -0.814215 1.921074
H -3.194126 -1.823949 1.959286
H -2.333877 1.917406 -0.207138
H -3.218666 1.416441 -1.671662
H -5.681079 -0.607900 0.164095
H -5.215713 -0.009612 -1.447911
H -3.043466 1.161013 1.962660
H -4.499434 0.149928 2.138662
H 3.222468 2.800905 2.307925
H 3.681730 2.755953 0.570234
H 3.761202 1.267070 1.558589
H 1.378742 3.765921 -0.063744
H -0.128961 3.039042 0.583750
H 1.015998 3.845518 1.687418
H 1.594220 0.131857 2.350980
H 1.143972 1.687039 3.112853
H 0.004888 0.868651 1.999314
H 1.941495 1.902275 -2.137112
H 5.433988 -2.163034 -0.812030
H 5.079542 -3.922054 -0.822343
H 4.288779 -2.822753 -1.999619
H 3.604533 -4.609067 0.978690
H 2.276799 -3.456764 1.623471


