%chk=000152069.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152069

0 1
 O    1.354200     -0.8390000     -0.6061000    
 O   0.9959000       2.785000     -0.2154000    
 O    3.153500       2.124500       1.619700    
 O    4.729800     -6.8899997E-02  0.6270000    
 O    2.591400      -3.132200      -1.427600    
 O   -2.349600      -1.119600       3.016300    
 N  -0.5385000      0.4776000      -1.024000    
 N   -2.552000      0.6620000      -2.048200    
 N   -1.264700     -0.3641000       1.149500    
 N   -3.650100     -0.5834000       1.224200    
 N   -5.091900     -5.2600000E-02 -0.6067000    
 C    1.328300       1.457700      0.1898000    
 C    2.835600       1.380500      0.4416000    
 C   0.9050000      0.4810000     -0.9096000    
 C    3.305000     -6.4999998E-02  0.6119000    
 C    2.778700     -0.9376000     -0.5326000    
 C    3.118900      -2.411900     -0.3374000    
 C   -1.418300      5.7000000E-02 -5.7100002E-02
 C   -1.251400      0.8014000      -2.147600    
 C   -2.735000      0.1947000     -0.7515000    
 C   -3.837400     -0.1377000     -7.1800001E-02
 C   -2.407500     -0.7094000       1.855600    
 H   0.8103000       1.267200       1.136500    
 H    3.383500       1.863800     -0.3775000    
 H    1.337100      0.7885000      -1.871200    
 H    2.963200     -0.4475000       1.581200    
 H    3.199900     -0.6172000      -1.495300    
 H    2.671100      -2.808800      0.5797000    
 H    4.199900      -2.574000     -0.3009000    
 H   3.4800000E-02   2.812600     -0.3601000    
 H    2.824900       3.030400       1.488600    
 H    5.040600      0.2333000     -0.2435000    
 H  -0.6991000       1.148500      -3.032900    
 H    1.630700      -2.982200      -1.445500    
 H   -4.484100     -0.8374000       1.745600    
 H   -5.219600      0.2734000      -1.556500    
 H   -5.888800     -0.3202000     -4.3499999E-02


%chk=000152069-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152069

0 1
O 1.553345 -0.896971 -0.960290
O 0.706232 2.195651 1.044768
O 3.257573 1.510224 2.022907
O 4.966644 0.034039 0.227601
O 3.137047 -2.513703 -2.714056
O -3.153308 2.235530 2.637169
N -0.587959 0.017865 -0.797892
N -2.427017 -1.014325 -1.722150
N -1.701005 1.256874 1.048711
N -4.094279 0.801127 1.055388
N -5.195103 -0.622344 -0.538172
C 1.257826 0.897797 0.719869
C 2.785403 1.089163 0.705923
C 0.842812 0.364551 -0.679954
C 3.527578 -0.201987 0.349444
C 3.033752 -0.712765 -1.016286
C 3.603882 -2.079939 -1.395402
C -1.680457 0.416966 -0.014742
C -1.105125 -0.833470 -1.808651
C -2.798391 -0.240048 -0.607548
C -4.069865 -0.034887 -0.038176
C -2.930407 1.492814 1.646861
H 0.983790 0.126965 1.474086
H 3.026222 1.871626 -0.048841
H 1.103769 1.120514 -1.454638
H 3.319575 -0.958502 1.137251
H 3.278578 0.030098 -1.804781
H 3.339363 -2.819799 -0.610343
H 4.699233 -2.004338 -1.466884
H -0.301464 2.032131 1.248883
H 2.658399 2.249797 2.311372
H 5.245031 0.547274 1.030363
H -0.451642 -1.288772 -2.546142
H 2.146765 -2.545821 -2.681323
H -4.967080 1.018164 1.546321
H -5.082920 -1.228278 -1.351508
H -6.122497 -0.482823 -0.144437


