%chk=000128492.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128492

0 1
 O    3.826300      -1.255500      -1.701800    
 O    6.807700     -0.5702000       1.261500    
 O    7.069000       1.552100      0.5280000    
 O  -0.7355000       3.112500      -1.442800    
 O   -3.301600      -2.486700       2.495600    
 O   -1.972500     -0.7438000       2.618700    
 O   -6.920000       1.896200     -0.9063000    
 O   -6.794900       1.646000       1.271100    
 N    4.306300     -0.7618000      0.5170000    
 N   -1.934500      -1.931000     -0.5556000    
 N   -2.899600      -1.380200       2.065400    
 N   -6.374900       1.407700      0.1130000    
 C   0.9525000      -2.550500     -0.8918000    
 C    2.171200      -3.477400     -0.8286000    
 C  -0.1795000      -3.180100      -1.710400    
 C    3.306400      -2.889200      8.1000002E-03
 C   -1.387400      -2.257500      -1.850300    
 C    4.880800      0.5467000      0.3015000    
 C    4.109900       1.623400       1.076300    
 C    3.824000      -1.558000     -0.5117000    
 C    2.817600       2.021100      0.4043000    
 C   -3.033300      -1.106500     -0.3697000    
 C    6.349800      0.5731000      0.6974000    
 C    2.804400       3.065000     -0.5208000    
 C    1.636700       1.344000      0.7088000    
 C   -3.517000     -0.8276000      0.9085000    
 C   -3.657100     -0.5528000      -1.487700    
 C   -4.624500      4.9999999E-03   1.068700    
 C    1.610300       3.431900      -1.141300    
 C   0.4426000       1.710800      8.8299997E-02
 C   -4.764500      0.2798000      -1.327500    
 C   -5.248200      0.5588000     -4.9300000E-02
 C   0.4294000       2.754800     -0.8368000    
 H   0.6181000      -2.338800      0.1301000    
 H    1.224800      -1.590900      -1.345100    
 H    2.530500      -3.673900      -1.846200    
 H    1.878700      -4.443300     -0.3996000    
 H  -0.4888000      -4.120200      -1.236500    
 H   0.1889000      -3.432000      -2.712200    
 H    4.152500      -3.586100      2.0000000E-02
 H    2.963200      -2.776200       1.043500    
 H   -2.139100      -2.768900      -2.463300    
 H   -1.074700      -1.346800      -2.375500    
 H    4.863700      0.7620000     -0.7741000    
 H    3.902700       1.287000       2.101500    
 H    4.722800       2.527100       1.194000    
 H    4.307600      -1.123400       1.466400    
 H   -1.555700      -2.402400      0.2575000    
 H    3.718400       3.598300     -0.7680000    
 H    1.633100      0.5281000       1.426800    
 H   -3.318000     -0.7400000      -2.502000    
 H   -4.985800      0.2100000       2.074700    
 H    1.606500       4.245300      -1.861700    
 H  -0.4702000       1.174400      0.3332000    
 H   -5.225200      0.6940000      -2.220800    
 H    7.756300     -0.5058000       1.502900    
 H   -1.449200       2.536700      -1.118100    


%chk=000128492-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000128492

0 1
O 4.317993 -1.240891 -1.647030
O 6.407732 -0.221307 2.284556
O 7.271412 1.484976 0.961675
O -0.981314 1.880815 -1.810821
O -3.757822 -1.936443 3.144149
O -2.133357 -2.698142 1.742213
O -6.833311 2.348818 -0.242469
O -6.926075 1.409691 1.840530
N 4.372343 -0.724844 0.620895
N -1.944555 -1.733706 -0.694392
N -3.164542 -1.924101 2.000558
N -6.404619 1.527052 0.663156
C 1.058606 -2.304422 -0.970408
C 2.268066 -3.262279 -1.053711
C -0.050911 -2.681690 -1.980028
C 3.402731 -2.891672 -0.070026
C -1.246672 -1.708476 -1.995409
C 5.050117 0.554205 0.420019
C 4.166909 1.795626 0.800783
C 4.061575 -1.559488 -0.444192
C 2.806398 1.808860 0.119365
C -3.008136 -0.956789 -0.354302
C 6.361259 0.664928 1.196374
C 2.676835 1.665223 -1.288046
C 1.628201 1.996238 0.882511
C -3.641758 -1.022194 0.953743
C -3.569325 -0.013867 -1.293449
C -4.749563 -0.211898 1.278620
C 1.415663 1.704542 -1.912711
C 0.353630 2.036509 0.273701
C -4.663278 0.782292 -0.969240
C -5.251143 0.681030 0.324196
C 0.253842 1.886064 -1.128156
H 0.659457 -2.311816 0.065033
H 1.395033 -1.268863 -1.173496
H 2.683537 -3.241270 -2.079150
H 1.940259 -4.300864 -0.849836
H -0.413847 -3.710926 -1.779812
H 0.381253 -2.694187 -2.999082
H 4.188299 -3.672030 -0.111313
H 3.022465 -2.866284 0.969932
H -1.955558 -1.994925 -2.799557
H -0.897824 -0.678613 -2.207182
H 5.297673 0.604367 -0.656015
H 4.031922 1.816036 1.899331
H 4.752382 2.696774 0.532842
H 4.210265 -1.041235 1.578213
H -1.623208 -2.375983 0.049466
H 3.563787 1.496133 -1.908329
H 1.701154 2.111603 1.970647
H -3.124138 0.060886 -2.287992
H -5.205997 -0.286395 2.269096
H 1.316931 1.596432 -2.996894
H -0.545656 2.181344 0.886227
H -5.090326 1.486024 -1.689164
H 7.258953 -0.089276 2.783281
H -1.732745 2.062706 -1.191597


