%chk=000157675.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157675

0 1
 O   -4.891000      0.9897000     -0.4653000    
 O   -5.194600      -1.842100      0.2858000    
 O  -0.9726000      0.8337000      -1.932800    
 O   -3.458000       1.450800      -2.152300    
 O    1.224400     -0.5638000      -1.998100    
 O    3.032600      -3.545300      0.4269000    
 O    5.069200      -2.913300     -0.3234000    
 N    1.935300      -1.189700      0.1184000    
 C   -4.482200     -0.8816000       1.062000    
 C   -5.109700      0.4977000      0.8801000    
 C   -3.065100     -0.8689000      0.5788000    
 C   -2.692700     -9.9999998E-03 -0.4612000    
 C   -1.374100     -1.1000000E-03 -0.9301000    
 C   -2.108500      -1.725100       1.138500    
 C  -0.4270000     -0.8509000     -0.3584000    
 C   -4.614600       1.537400       1.882300    
 C   -3.694700      0.8742000      -1.098600    
 C    3.348700      -1.219000     -0.1814000    
 C  -0.7936000      -1.712900      0.6733000    
 C    4.125900     -0.2526000      0.7220000    
 C   0.9542000     -0.8597000     -0.8220000    
 C    3.648700       1.175100      0.6056000    
 C    3.910400      -2.626300     -4.1800000E-02
 C    4.228500       2.010400     -0.3360000    
 C    2.639900       1.624300       1.442800    
 C    3.788000       3.329600     -0.4431000    
 C    2.199200       2.943500       1.335500    
 C    2.773400       3.796100      0.3926000    
 H   -4.536000      -1.188800       2.112900    
 H   -6.197600      0.4110000      0.9866000    
 H   -2.384600      -2.410300       1.935900    
 H   -4.813100       1.218900       2.910100    
 H   -3.542300       1.731600       1.778400    
 H   -5.119600       2.494500       1.711300    
 H    3.486600     -0.9380000      -1.232300    
 H  -9.7999997E-02  -2.417300       1.120200    
 H    4.050300     -0.5737000       1.770500    
 H    5.198400     -0.2972000      0.4894000    
 H    1.673900      -1.400500       1.075800    
 H   -6.110600      -1.860800      0.6117000    
 H  -5.5000000E-03  0.8737000      -1.993200    
 H    5.017500       1.655200     -0.9926000    
 H    2.187200      0.9706000       2.182700    
 H    4.234400       3.993300      -1.177900    
 H    1.409100       3.306700       1.986200    
 H    2.430000       4.823000      0.3089000    
 H    3.438700      -4.434900      0.5035000    


%chk=000157675-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157675

0 1
O -5.226470 0.510711 -0.744378
O -5.280525 -2.039675 0.785596
O -1.158958 0.591447 -2.060613
O -3.880996 0.588030 -2.582627
O 1.244515 0.044143 -1.687864
O 3.278882 -3.548480 0.342957
O 4.972179 -2.931347 -1.130518
N 1.959912 -1.267241 0.076626
C -4.592310 -0.809164 1.228592
C -5.343389 0.442524 0.749650
C -3.147007 -0.770865 0.753655
C -2.841958 -0.146916 -0.487498
C -1.472217 -0.073596 -0.916910
C -2.128883 -1.347565 1.545962
C -0.438767 -0.687907 -0.111075
C -4.893303 1.761871 1.389512
C -3.947030 0.360422 -1.361966
C 3.354264 -1.229199 -0.372488
C -0.795866 -1.313036 1.108881
C 4.277690 -0.368878 0.567105
C 0.961826 -0.617349 -0.607350
C 3.815778 1.075249 0.681202
C 3.957818 -2.627991 -0.474372
C 3.929163 1.959032 -0.422725
C 3.262477 1.564103 1.890705
C 3.500916 3.299394 -0.319160
C 2.833128 2.907020 1.999410
C 2.950766 3.778506 0.893289
H -4.632099 -0.875984 2.328859
H -6.425535 0.287577 0.902658
H -2.390612 -1.825368 2.495037
H -5.125465 1.761211 2.470570
H -3.810495 1.935527 1.265882
H -5.435250 2.600960 0.922056
H 3.357538 -0.780111 -1.380689
H -0.028879 -1.761895 1.750862
H 4.304717 -0.843980 1.566110
H 5.299263 -0.424381 0.145502
H 1.738297 -1.891739 0.852195
H -5.427806 -1.979686 -0.195276
H -0.119409 0.540483 -2.173207
H 4.351369 1.598512 -1.368857
H 3.174760 0.894018 2.755218
H 3.592547 3.968749 -1.181488
H 2.410654 3.271103 2.942693
H 2.617516 4.819111 0.973307
H 3.716055 -4.440149 0.283170


