%chk=000170831.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170831

0 1
 O   -1.658900      2.1500001E-02 -0.8787000    
 C   -2.526200      0.4487000      0.1676000    
 C   -1.679900      0.7808000       1.395700    
 C   -3.266700       1.689600     -0.3265000    
 C   -3.511500     -0.6785000      0.4736000    
 C  -0.5030000     -0.6038000     -0.5065000    
 C   0.6778000      0.1205000     -0.2748000    
 C    1.850700     -0.5727000      0.1083000    
 C  -0.5270000      -1.991500     -0.3627000    
 C   0.7204000       1.517200     -0.4149000    
 C    1.808300      -1.969500      0.2488000    
 C   0.6264000      -2.673000      1.4500000E-02
 C    3.031500      0.1513000      0.3402000    
 C    1.902300       2.220400     -0.1807000    
 C    3.055800       1.538800      0.1961000    
 H   -1.056900       1.668000       1.278100    
 H   -2.360900       1.046400       2.217500    
 H   -1.087100     -4.7600001E-02   1.796100    
 H   -3.840100       1.464300      -1.233000    
 H   -2.565700       2.487300     -0.5959000    
 H   -3.955500       2.077400      0.4310000    
 H   -3.015300      -1.546500      0.9189000    
 H   -4.285500     -0.3496000       1.175400    
 H   -4.001500      -1.028700     -0.4420000    
 H   -1.435500      -2.554200     -0.5580000    
 H  -0.1452000       2.084500     -0.7471000    
 H    2.698000      -2.522900      0.5418000    
 H   0.6080000      -3.753500      0.1229000    
 H    3.945000     -0.3607000      0.6352000    
 H    1.924400       3.299600     -0.3017000    
 H    3.976100       2.086700      0.3761000    


%chk=000170831-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170831

0 1
O -1.568530 0.272651 -0.725035
C -2.680637 0.502053 0.290530
C -2.076189 0.955866 1.634267
C -3.496528 1.620467 -0.379309
C -3.527146 -0.777566 0.460583
C -0.444074 -0.510893 -0.385869
C 0.820783 0.169969 -0.234073
C 2.007986 -0.614726 0.043768
C -0.508721 -1.907800 -0.303344
C 0.939518 1.591722 -0.366726
C 1.901069 -2.040551 0.153678
C 0.667666 -2.670050 -0.024912
C 3.263533 0.063222 0.197599
C 2.177597 2.221146 -0.215028
C 3.349478 1.451634 0.074371
H -1.465877 1.866197 1.506238
H -2.885802 1.177323 2.353729
H -1.437984 0.167352 2.071278
H -3.860328 1.287893 -1.366832
H -2.870950 2.517640 -0.527084
H -4.365888 1.893213 0.245681
H -2.966646 -1.565875 0.991836
H -4.431800 -0.549735 1.054391
H -3.845617 -1.161985 -0.524260
H -1.458968 -2.418153 -0.482455
H 0.039870 2.164705 -0.610560
H 2.801675 -2.628154 0.366505
H 0.591771 -3.761330 0.037765
H 4.160531 -0.531098 0.409791
H 2.257721 3.308549 -0.323431
H 4.314787 1.956613 0.192209


