%chk=000071522.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071522

1 1
 O  -0.7178000      0.2596000       1.042800    
 O    1.921600      4.3900002E-02   2.210200    
 O   6.2899999E-02  -1.888700      0.7909000    
 N   -4.110900     -0.8029000     -8.7700002E-02
 C   -4.922400      0.1397000      0.8246000    
 C   -4.821800     -0.7766000      -1.456300    
 C   -6.213600      0.3874000      6.9799997E-02
 C   -5.766200      0.4063000      -1.375300    
 C   -2.679000     -0.3073000     -0.2198000    
 C   -4.102000      -2.215500      0.4763000    
 C   -2.044800     -0.2374000       1.155400    
 C   0.2660000     -0.6824000      0.8596000    
 C    1.645600     -2.1900000E-02  0.7962000    
 C    1.635000       1.384800      0.1929000    
 C    2.690900     -0.9028000      0.1084000    
 C    1.353900       1.524400      -1.146600    
 C    3.968300     -0.9297000      0.6191000    
 C    1.906600       2.455200       1.013400    
 C    2.313400      -1.634600     -0.9940000    
 C    1.344100       2.806300      -1.696500    
 C    4.921200      -1.732900     -7.6000001E-03
 C    1.896600       3.737100      0.4633000    
 C    3.266400      -2.437700      -1.620400    
 C    1.615400       3.912600     -0.8916000    
 C    4.570200      -2.486800      -1.127200    
 H   -5.069200     -0.3166000       1.807900    
 H   -4.383300       1.088500      0.9197000    
 H   -4.080500     -0.6875000      -2.256400    
 H   -5.376800      -1.713600      -1.575000    
 H   -6.696100       1.321400      0.3711000    
 H   -6.920300     -0.4329000      0.2427000    
 H   -6.602600      0.3145000      -2.073900    
 H   -5.233500       1.337600      -1.601100    
 H   -2.698900      0.6793000     -0.6986000    
 H   -2.139100     -0.9922000     -0.8842000    
 H   -3.438900      -2.832400     -0.1370000    
 H   -5.124200      -2.605800      0.4333000    
 H   -3.786100      -2.205400       1.521300    
 H   -2.028200      -1.194000       1.684300    
 H   -2.561300      0.4635000       1.816200    
 H    1.206800      0.5364000       2.650300    
 H    1.113200      0.6870000      -1.790300    
 H    4.264700     -0.3412000       1.481400    
 H    2.142100       2.365900       2.067700    
 H    1.312200      -1.607400      -1.411000    
 H    1.119100       2.943800      -2.750100    
 H    5.937400      -1.768800      0.3743000    
 H    2.110100       4.598900       1.089000    
 H    2.994500      -3.022300      -2.494500    
 H    1.606700       4.910700      -1.319500    
 H    5.312500      -3.110900      -1.616100    


%chk=000071522-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000071522

1 1
O -0.644127 0.278284 1.619013
O 1.896085 0.832298 1.933945
O -0.292306 -1.270849 -0.076296
N -3.962918 -0.376269 -0.054205
C -4.854387 -1.050346 1.039858
C -4.949455 0.515318 -0.890604
C -6.300211 -0.869633 0.552153
C -6.266999 0.533875 -0.098136
C -2.873599 0.510010 0.581839
C -3.332438 -1.429915 -0.966484
C -2.040883 -0.196748 1.684098
C 0.169752 -0.370504 0.654129
C 1.589364 0.255636 0.621970
C 1.572538 1.353546 -0.475106
C 2.636051 -0.852669 0.390101
C 0.869570 1.201021 -1.698258
C 3.050988 -1.628861 1.501685
C 2.325420 2.532294 -0.249953
C 3.166972 -1.126807 -0.890759
C 0.909891 2.222319 -2.675000
C 3.989418 -2.668270 1.329412
C 2.362763 3.550327 -1.228158
C 4.105668 -2.169746 -1.060208
C 1.652065 3.402337 -2.441517
C 4.517470 -2.944798 0.046748
H -4.530815 -2.094750 1.164415
H -4.689855 -0.501767 1.981461
H -4.484350 1.500527 -1.047805
H -5.077250 0.018443 -1.865414
H -7.012609 -0.937397 1.389672
H -6.577434 -1.643436 -0.186222
H -7.126039 0.717448 -0.762825
H -6.264734 1.324793 0.673331
H -3.387517 1.397413 0.987540
H -2.209100 0.834788 -0.236547
H -2.896932 -0.923770 -1.841868
H -4.120068 -2.128284 -1.288294
H -2.526728 -1.958497 -0.437611
H -2.053450 -1.295989 1.575097
H -2.371417 0.081161 2.695352
H 1.160105 1.442670 2.201148
H 0.322334 0.274331 -1.909132
H 2.665615 -1.390447 2.497497
H 2.888446 2.633180 0.682741
H 2.870662 -0.524011 -1.754429
H 0.378377 2.089386 -3.624037
H 4.314345 -3.256277 2.194576
H 2.955063 4.453534 -1.046813
H 4.520239 -2.369758 -2.054040
H 1.687579 4.190863 -3.200656
H 5.248741 -3.749403 -0.086005


