%chk=000107988.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107988

0 1
 O    2.248600     -0.1605000     -0.9821000    
 O    4.384800       1.704700      0.1711000    
 O    3.044800      -2.815500     -0.5690000    
 O  -0.5946000       2.732000     -0.4190000    
 O   -3.684900     -0.5755000      0.1361000    
 N   0.1600000      0.5562000     -0.2081000    
 N   -2.181100       1.128100     -0.1450000    
 C    3.627400      0.6535000      0.7665000    
 C    1.545900      0.9041000     -0.3256000    
 C    2.214500       1.125400       1.021400    
 C    3.437500     -0.4788000     -0.2332000    
 C    3.221900      -1.830100      0.4356000    
 C  -0.1748000     -0.7824000     -3.3500001E-02
 C  -0.8637000       1.539400     -0.2654000    
 C   -1.434200      -1.216400      8.7200001E-02
 C   -2.417500     -0.1284000      1.4600000E-02
 C   -1.835100      -2.639000      0.2754000    
 C   -4.662100      0.4511000      7.0400000E-02
 C   -6.037300     -0.1680000      0.2024000    
 H    4.151800      0.3431000       1.675100    
 H    1.653300       1.797900     -0.9514000    
 H    1.752500      0.5040000       1.798200    
 H    2.141400       2.170200       1.339000    
 H    4.261100     -0.5409000     -0.9531000    
 H    2.358600      -1.844900       1.104700    
 H    4.106700      -2.101400       1.021400    
 H    4.433700       2.429900      0.8172000    
 H   0.6221000      -1.506900     -3.0000000E-03
 H    2.923400      -3.667400     -0.1162000    
 H   -2.477800      -2.969000     -0.5471000    
 H   -2.381000      -2.763000       1.216200    
 H  -0.9665000      -3.305300      0.3057000    
 H   -4.518900       1.166400      0.8893000    
 H   -4.604800      0.9728000     -0.8927000    
 H   -6.817400      0.5971000      0.1562000    
 H   -6.210200     -0.8974000     -0.5958000    
 H   -6.127700     -0.7077000       1.151000    


%chk=000107988-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000107988

0 1
O 2.440230 -0.225705 -1.030465
O 4.702410 1.504703 -0.011426
O 2.640334 -2.835006 0.077979
O -0.338932 2.660091 0.039503
O -3.700124 -0.634179 0.151008
N 0.220170 0.421780 -0.335390
N -2.063788 1.047272 0.107452
C 3.694009 0.760341 0.753811
C 1.632226 0.891355 -0.564098
C 2.298700 1.431716 0.731789
C 3.465898 -0.559078 -0.009402
C 3.016069 -1.694249 0.922559
C -0.138344 -0.906601 -0.467179
C -0.743753 1.462013 -0.051307
C -1.454275 -1.314447 -0.300137
C -2.383747 -0.246398 -0.007509
C -1.895154 -2.752643 -0.435919
C -4.697220 0.445225 0.428961
C -6.051892 -0.243793 0.554776
H 4.049061 0.591278 1.792305
H 1.588577 1.652783 -1.359835
H 1.706752 1.133892 1.614739
H 2.342175 2.531769 0.723059
H 4.361940 -0.860055 -0.574754
H 2.157834 -1.373688 1.552198
H 3.868384 -1.950222 1.588024
H 4.713603 2.446901 0.293492
H 0.674124 -1.597107 -0.717346
H 2.499688 -3.632620 0.647167
H -2.649563 -2.864163 -1.235894
H -2.367977 -3.117063 0.494619
H -1.036280 -3.403737 -0.673928
H -4.393088 0.970364 1.351702
H -4.659487 1.173889 -0.399999
H -6.833277 0.509925 0.762365
H -6.316493 -0.770375 -0.378285
H -6.048390 -0.976767 1.379864


