%chk=000174620.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174620

0 1
 O   -2.510600      -2.055100      0.3806000    
 O   -2.270900       2.017800     -3.1700000E-02
 O   -3.339400      0.2181000      -1.002500    
 N   0.4510000      2.1700000E-02   1.110100    
 C  -0.4387000     -0.9392000      0.7220000    
 C   0.1723000      -1.737500     -0.2208000    
 C   -1.813300      -1.142700       1.263600    
 C  -0.5519000      -2.888300     -0.8201000    
 C    1.479500      -1.228200     -0.4403000    
 C    1.629000     -0.1243000      0.4070000    
 C   -1.758000      -3.240600      6.6299997E-02
 C   -2.626600      0.1411000       1.320500    
 C    2.806900      0.6299000      0.4596000    
 C    2.555900      -1.594500      -1.272700    
 C    2.973500       1.807400       1.361600    
 C    3.859700      0.2473000     -0.3763000    
 C    3.738300     -0.8472000      -1.229700    
 C   -2.804500      0.7602000     -4.5200001E-02
 C    2.541000       3.111600      0.6978000    
 C   -2.362300       2.739300      -1.264300    
 C   -1.730800       4.103400      -1.085300    
 H   -1.763800      -1.599800       2.258900    
 H  -0.9054000      -2.591900      -1.814900    
 H   0.1016000      -3.759000     -0.9334000    
 H   0.2735000      0.7365000       1.802200    
 H   -2.421200      -3.929600     -0.4663000    
 H   -1.446900      -3.727900      0.9987000    
 H   -2.167100      0.8630000       2.006000    
 H   -3.635400     -6.0199998E-02   1.701200    
 H    2.476200      -2.445700      -1.942800    
 H    2.396900       1.662100       2.282800    
 H    4.020400       1.890900       1.678900    
 H    4.793200      0.8058000     -0.3708000    
 H    4.570900      -1.125400      -1.870500    
 H    3.129900       3.312200     -0.2035000    
 H    2.677900       3.950300       1.387600    
 H    1.485100       3.077000      0.4094000    
 H   -1.834300       2.187200      -2.049800    
 H   -3.415700       2.852500      -1.543900    
 H   -1.785100       4.684000      -2.010400    
 H   -2.234600       4.659900     -0.2881000    
 H  -0.6809000       4.006000     -0.7903000    


%chk=000174620-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174620

0 1
O -2.578616 -2.035959 0.333720
O -1.671024 2.015657 0.032148
O -3.445345 0.933190 -1.035116
N 0.476916 0.065117 1.055564
C -0.439125 -0.922572 0.658322
C 0.175162 -1.805070 -0.227307
C -1.849222 -1.071857 1.177246
C -0.556110 -2.998186 -0.791534
C 1.533316 -1.335654 -0.422780
C 1.692284 -0.153092 0.385380
C -1.802986 -3.270640 0.080638
C -2.717283 0.215054 1.222791
C 2.901759 0.584419 0.449472
C 2.633290 -1.799866 -1.191599
C 3.035023 1.839709 1.299461
C 3.969731 0.089409 -0.332473
C 3.841735 -1.079368 -1.139343
C -2.690164 1.046504 -0.048682
C 2.335919 3.081489 0.679721
C -1.505040 2.900260 -1.165657
C -2.424541 4.120441 -1.068241
H -1.821184 -1.469863 2.220828
H -0.865295 -2.809492 -1.838390
H 0.085884 -3.901699 -0.800064
H 0.211337 0.939220 1.505601
H -2.518073 -3.942090 -0.421708
H -1.498056 -3.718742 1.051940
H -2.385236 0.841631 2.069156
H -3.755115 -0.111906 1.403490
H 2.544272 -2.698131 -1.812935
H 2.620470 1.658836 2.312708
H 4.107310 2.069708 1.440508
H 4.929275 0.621026 -0.309771
H 4.704537 -1.420347 -1.722741
H 2.766444 3.314288 -0.310572
H 2.459986 3.968381 1.328250
H 1.251970 2.911053 0.541095
H -0.439027 3.178202 -1.141264
H -1.720382 2.304286 -2.069325
H -2.229752 4.801935 -1.917131
H -3.483547 3.815513 -1.108355
H -2.246196 4.677305 -0.131853


