%chk=000034712.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034712

0 1
 O   0.2419000     -0.1538000      -1.316700    
 O    3.139700      0.6414000      0.6290000    
 C  -0.3672000      1.2500000E-02 -1.9099999E-02
 C   0.7400000      0.5123000      0.9073000    
 C   -1.506000       1.020400     -0.1409000    
 C  -0.9104000      -1.350100      0.4182000    
 C    1.980100     -8.7800004E-02  0.2878000    
 C    1.661400      2.2000000E-03  -1.188700    
 C   -2.153000       1.261800       1.219800    
 C  -0.9983000       2.330300     -0.7369000    
 C   -2.036800      -1.800600     -0.5086000    
 C   0.2085000      -2.388500      0.4488000    
 H   0.6111000      0.1999000       1.949700    
 H   0.8548000       1.599000      0.9355000    
 H   -2.266500      0.6786000     -0.8508000    
 H   -1.314600      -1.303800       1.436400    
 H    2.200600      -1.108100      0.5832000    
 H    1.945000      0.9729000      -1.611000    
 H    2.169600     -0.7721000      -1.771500    
 H   -1.438300       1.607500       1.973000    
 H   -2.921600       2.039100       1.133000    
 H   -2.660400      0.3737000       1.605700    
 H  -0.3589000       2.901100     -5.8699999E-02
 H   -1.851800       2.981600     -0.9629000    
 H  -0.4643000       2.183100      -1.680600    
 H   -1.758900      -1.738800      -1.565900    
 H   -2.300000      -2.846000     -0.3076000    
 H   -2.958500      -1.233000     -0.3515000    
 H   0.7910000      -2.455000     -0.4731000    
 H  -0.2352000      -3.385500      0.5759000    
 H   0.8427000      -2.277000       1.331900    
 H    3.222700      0.6248000       1.597800    


%chk=000034712-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034712

0 1
O 0.282234 -0.287280 -1.292874
O 3.156417 1.057250 0.473855
C -0.376372 -0.074092 0.051975
C 0.782783 0.345019 1.010520
C -1.453410 1.046739 -0.133843
C -1.010263 -1.453672 0.450614
C 2.101709 0.059135 0.243091
C 1.678454 0.166168 -1.233668
C -2.237771 1.331460 1.171892
C -0.871078 2.355437 -0.718874
C -2.121266 -1.898350 -0.533083
C 0.051975 -2.574734 0.556789
H 0.732682 -0.188748 1.975294
H 0.752590 1.429448 1.216837
H -2.165625 0.662302 -0.889442
H -1.461394 -1.318948 1.456033
H 2.480794 -0.956165 0.474301
H 1.779449 1.224894 -1.550468
H 2.264550 -0.477526 -1.910133
H -1.559960 1.650389 1.986942
H -2.964322 2.148575 1.008151
H -2.802176 0.449229 1.523775
H -0.170374 2.857212 -0.025415
H -1.690535 3.068200 -0.927356
H -0.344286 2.158094 -1.667791
H -1.731764 -1.900456 -1.566848
H -2.459077 -2.922494 -0.288927
H -3.008614 -1.241736 -0.497457
H 0.549734 -2.720394 -0.418206
H -0.430813 -3.526991 0.843487
H 0.824663 -2.358297 1.317205
H 3.529466 0.932433 1.382126


