%chk=000065567.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065567

0 1
 O   -5.708700     -0.5893000      0.4216000    
 O   -3.698400       2.294700      0.8705000    
 O   -2.599700      -3.396700     -0.1811000    
 O   -6.177300       1.461000       1.207100    
 O    7.721600       1.524200      8.2199998E-02
 O    7.584900     -0.6689000     -1.6899999E-02
 N   -1.000400      -1.730200     -7.2800003E-02
 N    1.474500      0.8783000      4.8000000E-02
 N    7.051200      0.4652000      3.3500001E-02
 C   -4.090100       1.216000      1.8100001E-02
 C   -3.019400      0.1601000      1.0200000E-02
 C  -0.6783000     -0.3845000     -9.9999998E-03
 C   -3.359200      -1.139500     -6.4400002E-02
 C   0.2172000      -2.566000     -0.1087000    
 C   -1.621000      0.5606000      2.6900001E-02
 C    1.303700      -1.542900     -6.1500002E-02
 C   0.7726000     -0.2623000     -4.1000000E-03
 C   -2.297900      -2.207600     -0.1106000    
 C   -4.352300       1.764000      -1.386900    
 C   -4.787700      -1.561400     -0.1199000    
 C   -5.400400      0.7146000      0.6140000    
 C    2.671100      -1.685200     -6.7000002E-02
 C    3.459700     -0.5240000     -1.4100000E-02
 C   -5.408800       2.849900      -1.365000    
 C    2.816700      0.7451000      4.3099999E-02
 C    4.861200     -0.6035000     -1.6600000E-02
 C    3.618300       1.880600      9.5200002E-02
 C    5.634200      0.5532000      3.6499999E-02
 C    5.012600       1.794500      9.2500001E-02
 H   0.2212000      -3.146700      -1.035800    
 H   0.2185000      -3.226600      0.7634000    
 H   -1.364100       1.613300      6.1200000E-02
 H   -3.431600       2.200900      -1.794600    
 H   -4.667900      0.9675000      -2.071900    
 H   -4.938800      -2.471300      0.4703000    
 H   -5.089900      -1.775900      -1.150300    
 H    3.119600      -2.673200     -0.1113000    
 H   -5.473000       3.313600      -2.355900    
 H   -5.177600       3.647100     -0.6521000    
 H   -6.404400       2.454400      -1.143700    
 H   -3.479200       1.929300       1.745200    
 H    5.327300      -1.586500     -6.0899999E-02
 H    3.157800       2.866100      0.1396000    
 H    5.578100       2.722100      0.1350000    


%chk=000065567-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000065567

0 1
O -5.606843 -0.598856 0.732668
O -3.636647 2.534084 0.682167
O -2.533933 -3.362618 -0.360308
O -5.890750 1.448454 1.713914
O 7.931220 1.432093 0.235179
O 7.758464 -0.830740 -0.004151
N -0.975445 -1.622543 -0.176919
N 1.581045 0.902257 0.117503
N 7.242123 0.347015 0.115640
C -4.100288 1.304388 0.054191
C -2.963517 0.288049 0.003611
C -0.625345 -0.276733 -0.029851
C -3.309379 -1.058436 -0.132199
C 0.201904 -2.528807 -0.256497
C -1.599214 0.706977 0.067170
C 1.356375 -1.557027 -0.142328
C 0.840961 -0.212101 -0.007461
C -2.304909 -2.114562 -0.232359
C -4.596923 1.626801 -1.399517
C -4.756418 -1.472590 -0.143085
C -5.267176 0.730227 0.901540
C 2.728368 -1.752010 -0.147726
C 3.575401 -0.595597 -0.017773
C -5.763582 2.631732 -1.444332
C 2.956549 0.717772 0.113608
C 4.996935 -0.695719 -0.014162
C 3.790348 1.875688 0.244741
C 5.761804 0.465188 0.115160
C 5.178030 1.761811 0.246579
H 0.179548 -3.090900 -1.208235
H 0.157174 -3.272704 0.560292
H -1.335594 1.755053 0.208118
H -3.720473 2.044273 -1.929983
H -4.872249 0.689734 -1.920404
H -4.877249 -2.488515 0.262481
H -5.202495 -1.446498 -1.155723
H 3.177359 -2.746516 -0.246625
H -6.010685 2.876463 -2.492510
H -5.487289 3.569402 -0.932731
H -6.676588 2.234268 -0.965984
H -4.331015 2.804011 1.346973
H 5.498664 -1.663582 -0.110954
H 3.294188 2.845033 0.342982
H 5.833445 2.630381 0.345300


