%chk=000178920.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178920

0 1
 O   -2.528400      -2.479300       1.168300    
 O   -2.184000       2.524000      0.3151000    
 O    3.365600      9.4599999E-02  0.5458000    
 O    2.696800      -1.284800      -1.188900    
 N   8.5000001E-02   2.272600      0.3849000    
 C   -1.305200      0.4824000     -0.6217000    
 C  -5.3199999E-02 -0.4242000     -0.5637000    
 C   -2.452600     -0.3521000     -2.0000001E-03
 C   -1.891200      -1.770200      0.1225000    
 C  -0.4215000      -1.529800      0.4264000    
 C    1.210800      0.2852000     -0.2171000    
 C   -1.187400       1.835600      8.4500000E-02
 C   -3.732500     -0.3100000     -0.8295000    
 C    1.230900       1.547600      0.2149000    
 C    2.492800     -0.4064000     -0.3650000    
 C    4.674200     -0.4849000      0.5254000    
 H   -1.513200      0.7159000      -1.675000    
 H   6.0899999E-02 -0.8797000      -1.558100    
 H   -2.701300      2.1400001E-02   1.001200    
 H   -2.000300      -2.337500     -0.8099000    
 H   0.1729000      -2.438600      0.2823000    
 H  -0.2832000      -1.216700       1.469500    
 H   -4.518900     -0.9128000     -0.3641000    
 H   -4.103500      0.7162000     -0.9169000    
 H   -3.566200     -0.6955000      -1.841100    
 H    2.129300       2.097000      0.4698000    
 H   0.1857000       3.202300      0.7826000    
 H   -3.468300      -2.565600      0.9363000    
 H    5.273600      1.4000000E-03   1.299500    
 H    5.148600     -0.3141000     -0.4456000    
 H    4.617600      -1.555300      0.7452000    


%chk=000178920-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178920

0 1
O -2.735285 -2.341935 1.356502
O -2.269746 2.507745 0.586220
O 3.620522 0.263572 0.210681
O 2.564412 -1.619094 -0.685717
N 0.020071 2.241526 0.741994
C -1.296137 0.532271 -0.526133
C -0.066584 -0.424146 -0.357478
C -2.562608 -0.329096 -0.173234
C -2.001422 -1.726950 0.241959
C -0.552936 -1.471674 0.683457
C 1.225058 0.274200 0.010942
C -1.249951 1.814068 0.314326
C -3.601388 -0.386187 -1.309093
C 1.211472 1.535783 0.545282
C 2.483437 -0.460398 -0.196429
C 4.910412 -0.438443 0.031183
H -1.363295 0.888181 -1.574911
H 0.092364 -0.963341 -1.310990
H -3.041746 0.108106 0.723210
H -2.015283 -2.405826 -0.640921
H 0.068624 -2.380445 0.687409
H -0.560894 -1.044905 1.704861
H -4.449663 -1.048422 -1.046219
H -4.016646 0.616533 -1.513194
H -3.152599 -0.772813 -2.244546
H 2.133978 2.038019 0.846124
H 0.037419 3.145179 1.223318
H -3.663902 -2.528421 1.066435
H 5.668966 0.269641 0.394204
H 5.071583 -0.682097 -1.032645
H 4.925567 -1.371929 0.619002


