%chk=000026649.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026649

0 1
 O   -7.100100      -2.080300      0.1535000    
 O    5.854400     -0.5598000     -0.1576000    
 N   -1.742500      0.9947000      0.2324000    
 C  -0.4000000      0.8594000     -0.3357000    
 C   -2.601900     -9.4599999E-02 -0.2166000    
 C   0.2199000     -0.4738000      0.1210000    
 C   -2.319600       2.289800     -0.1314000    
 C   -3.982200      1.7999999E-02  0.4283000    
 C  -0.5086000      0.9643000      -1.856900    
 C    1.727900     -0.4964000      4.6300001E-02
 C   -4.896700      -1.119900     -2.2100000E-02
 C   -1.434100       3.434600      0.3304000    
 C   -6.289200     -0.9943000      0.5818000    
 C    2.343500     -0.9241000      -1.118900    
 C    2.467800     -8.9800000E-02   1.145000    
 C    3.736500     -0.9458000      -1.187300    
 C    3.860700     -0.1114000       1.076600    
 C    4.495200     -0.5393000     -8.9599997E-02
 C    6.569100     -0.1314000       1.000600    
 H   0.2569000       1.652500      3.6899999E-02
 H   -2.206200      -1.072400      7.5599998E-02
 H   -2.752900     -0.1072000      -1.301200    
 H  -5.9300002E-02 -0.6856000       1.163400    
 H  -0.1616000      -1.319900     -0.4659000    
 H   -2.602000       2.398100      -1.183800    
 H   -3.241600       2.445400      0.4387000    
 H   -4.492600      0.9428000      0.1422000    
 H   -3.892500      1.0300000E-02   1.521700    
 H   0.5042000      0.9714000      -2.279300    
 H   -1.006000      0.1123000      -2.329600    
 H  -0.9533000       1.890200      -2.227900    
 H   -4.976700      -1.133600      -1.116400    
 H   -4.465500      -2.088700      0.2592000    
 H   -1.091300       3.297200       1.362000    
 H  -0.5655000       3.584400     -0.3181000    
 H   -2.003700       4.371000      0.3038000    
 H   -6.773600     -6.0300000E-02  0.2794000    
 H   -6.243400      -1.018700       1.675000    
 H    1.763000      -1.246600      -1.978400    
 H    1.982000      0.2476000       2.056200    
 H    4.225100      -1.280900      -2.098100    
 H    4.388500      0.2182000       1.965000    
 H   -7.150600      -2.043300     -0.8169000    
 H    6.375700     -0.7855000       1.857500    
 H    7.636500     -0.2131000      0.7705000    
 H    6.370900      0.9214000       1.229100    


%chk=000026649-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000026649

0 1
O -7.179302 -2.294487 0.125936
O 5.880905 -0.887648 -0.116136
N -1.832011 1.146750 -0.075503
C -0.406243 0.897073 -0.454264
C -2.816078 0.189491 -0.640110
C 0.139936 -0.360916 0.292640
C -2.251616 2.565899 -0.213771
C -3.992614 -0.087696 0.324095
C -0.151767 0.822187 -1.984997
C 1.653085 -0.500356 0.214317
C -5.039506 -1.047767 -0.285494
C -1.690001 3.477389 0.895924
C -6.198220 -1.346580 0.682610
C 2.273884 -1.411366 -0.682664
C 2.495278 0.298120 1.026615
C 3.674513 -1.518532 -0.771338
C 3.904516 0.209040 0.954688
C 4.496010 -0.704684 0.047423
C 6.770267 -0.070245 0.709966
H 0.165395 1.760270 -0.061263
H -2.303390 -0.769622 -0.840037
H -3.223589 0.535334 -1.623544
H -0.188475 -0.266630 1.344760
H -0.338988 -1.271366 -0.118052
H -1.980743 2.985784 -1.215049
H -3.355840 2.592632 -0.158508
H -4.481825 0.868029 0.602591
H -3.582422 -0.511804 1.260929
H 0.929093 0.736383 -2.193602
H -0.653020 -0.056313 -2.432968
H -0.525817 1.728506 -2.496494
H -5.446590 -0.605949 -1.221116
H -4.560149 -2.005964 -0.567886
H -1.993125 3.097729 1.887344
H -0.586177 3.526477 0.872670
H -2.070568 4.509526 0.777758
H -6.695452 -0.399629 0.988707
H -5.824574 -1.848178 1.591502
H 1.647702 -2.048381 -1.319437
H 2.043647 0.999326 1.740101
H 4.153064 -2.222364 -1.459336
H 4.519382 0.839824 1.603958
H -7.547407 -1.913698 -0.711431
H 6.617307 -0.270033 1.788849
H 7.788335 -0.368878 0.419393
H 6.627791 1.010219 0.510623


