%chk=000130702.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130702

0 1
 O    6.681100      0.1932000     -0.4775000    
 O   -7.082700     -6.2899999E-02 -4.0600002E-02
 N    3.276300       1.181200     -0.4788000    
 N    4.627800       1.212100     -0.5252000    
 N   -3.013100      1.3300000E-02 -3.1599998E-02
 C    3.472400      -1.053000      0.5426000    
 C    4.753800      -1.201500     -0.2617000    
 C    2.680600      0.1203000     -2.0300001E-02
 C    1.206400      9.2699997E-02 -2.2200000E-02
 C    3.759400     -0.8309000       2.028900    
 C    5.454900      0.1204000     -0.4071000    
 C   0.5376000      -1.124100     -0.1219000    
 C   0.4918000       1.283400      7.4500002E-02
 C   -1.577300      4.0100001E-02 -2.8500000E-02
 C  -0.8570000      -1.150500     -0.1251000    
 C  -0.9028000       1.257000      7.1500003E-02
 C   -3.724400     -0.9763000     -0.7080000    
 C   -3.763900      0.9757000      0.6414000    
 C   -5.060600      -1.066800     -0.7576000    
 C   -5.102900       1.016300      0.6850000    
 C   -5.857500     -3.9900001E-02 -3.7799999E-02
 H    2.929900      -1.995200      0.4557000    
 H    4.528100      -1.562000      -1.272600    
 H    5.432300      -1.920100      0.2108000    
 H    4.353400      -1.654000       2.439400    
 H    4.301300      0.1038000       2.208200    
 H    2.823400     -0.7757000       2.595700    
 H    1.051400      -2.072500     -0.2282000    
 H   0.9940000       2.243800      0.1544000    
 H    5.019700       2.130000     -0.7098000    
 H   -1.341500      -2.121100     -0.1775000    
 H   -1.423400       2.209000      0.1160000    
 H   -3.134800      -1.694600      -1.266000    
 H   -3.204000       1.715700       1.201600    
 H   -5.573700      -1.842800      -1.310800    
 H   -5.647100       1.772700       1.235500    


%chk=000130702-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000130702

0 1
O 6.819446 0.541431 -0.254463
O -7.253720 -0.020797 -0.059682
N 3.272156 1.332302 -0.085949
N 4.669719 1.393965 -0.067677
N -3.070821 0.036702 -0.017239
C 3.548701 -1.121923 0.298377
C 4.894854 -1.008379 -0.462374
C 2.710345 0.134932 0.051730
C 1.228840 0.094945 0.031550
C 3.771816 -1.311688 1.827120
C 5.574346 0.335970 -0.237060
C 0.507113 -1.096544 0.318544
C 0.478136 1.268917 -0.272223
C -1.629370 0.055395 0.001645
C -0.901154 -1.117985 0.312195
C -0.923999 1.252377 -0.294178
C -3.769595 -1.075057 -0.511102
C -3.809689 1.129883 0.460132
C -5.144301 -1.119184 -0.536101
C -5.185296 1.136348 0.456700
C -5.973947 -0.002838 -0.047084
H 3.016449 -2.008140 -0.089995
H 4.731422 -1.113751 -1.554030
H 5.595163 -1.804101 -0.158870
H 4.349932 -2.234297 2.016494
H 4.334394 -0.462419 2.255139
H 2.811843 -1.386344 2.367262
H 1.036415 -2.019364 0.575005
H 1.024364 2.186023 -0.508629
H 5.044503 2.344801 -0.036062
H -1.429011 -2.037613 0.584365
H -1.471990 2.156775 -0.578099
H -3.149990 -1.879825 -0.913115
H -3.220863 1.952290 0.872489
H -5.652196 -1.995997 -0.947909
H -5.725113 1.999992 0.855493


