%chk=000160877.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160877

1 1
 O   -4.133600     -0.4062000     -2.1700000E-02
 O   -2.907900       2.087700      9.8999999E-03
 N    3.732800      1.1600000E-02 -0.2818000    
 C    2.240200     -3.4299999E-02 -0.5749000    
 C    1.445200     -1.0000000E-03  0.7259000    
 C    4.508200     -1.9400001E-02  -1.591000    
 C    4.062200       1.291700      0.4727000    
 C    4.120700      -1.191100      0.5662000    
 C  -4.6599999E-02 -0.1060000      0.5257000    
 C  -0.7932000       1.050000      0.3592000    
 C  -0.6446000      -1.356600      0.5124000    
 C   -2.172500      0.9530000      0.1747000    
 C   -2.023600      -1.453600      0.3280000    
 C   -2.787600     -0.2989000      0.1589000    
 C   -4.599700     -0.5271000      -1.364300    
 H    2.041400     -0.9517000      -1.142500    
 H    1.997300      0.8239000      -1.213600    
 H    1.727300     -0.8142000       1.402300    
 H    1.627600      0.9239000       1.284400    
 H    4.215300      0.8504000      -2.186500    
 H    5.578300      1.6400000E-02  -1.365700    
 H    4.260400     -0.9462000      -2.117000    
 H    3.627700       2.139100     -6.5600000E-02
 H    3.685300       1.234300       1.496600    
 H    5.152100       1.391600      0.5074000    
 H    3.762700      -1.064600       1.590500    
 H    3.709100      -2.094400      0.1065000    
 H    5.213900      -1.250100      0.5871000    
 H  -0.3100000       2.023600      0.3693000    
 H  -5.7999998E-02  -2.261900      0.6405000    
 H   -2.496200      -2.432000      0.3168000    
 H   -2.315200       2.857900      4.8099998E-02
 H   -4.314200      0.3509000      -1.952400    
 H   -5.690900     -0.5941000      -1.343400    
 H   -4.202000      -1.435600      -1.827600    


%chk=000160877-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160877

1 1
O -3.959090 -0.970605 -0.922093
O -3.015338 1.798096 -0.728692
N 3.876154 -0.012793 -0.146977
C 2.338274 -0.165273 -0.375546
C 1.434179 0.078370 0.851450
C 4.578251 -0.297318 -1.475247
C 4.214782 1.405778 0.301572
C 4.366479 -1.011946 0.897653
C -0.012165 -0.154639 0.416706
C -0.853202 0.933012 0.079950
C -0.523488 -1.470526 0.295726
C -2.180467 0.728554 -0.363243
C -1.846193 -1.680569 -0.135136
C -2.700268 -0.600023 -0.470497
C -5.124468 -0.059154 -0.834034
H 2.192064 -1.191422 -0.755337
H 2.081132 0.542302 -1.183540
H 1.690549 -0.617021 1.671630
H 1.550160 1.109984 1.229196
H 4.222370 0.418759 -2.231521
H 5.665921 -0.190250 -1.342211
H 4.340256 -1.323086 -1.795372
H 3.821231 2.118890 -0.438862
H 3.761857 1.598181 1.284164
H 5.308890 1.507050 0.373067
H 3.922710 -0.771392 1.873647
H 4.068416 -2.026302 0.591526
H 5.463725 -0.948979 0.964855
H -0.479155 1.963419 0.168504
H 0.093563 -2.335292 0.569557
H -2.265157 -2.687764 -0.215788
H -2.574661 2.670274 -0.575211
H -5.237063 0.330813 0.192513
H -5.980310 -0.698731 -1.094739
H -5.028039 0.776602 -1.542571


