%chk=000151356.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151356

0 1
 O    1.343500      0.6936000       2.269900    
 O    3.070600       1.795400      -1.853800    
 O   0.3340000      -1.382300      -2.538800    
 O    4.311200       2.885100      0.3954000    
 O   -4.684100       1.358500      0.3214000    
 O   -5.294100     -0.8165000     -0.2927000    
 N    1.465900      0.1732000      -1.200300    
 N    2.397800       1.552700      0.3604000    
 C   0.7860000     -0.2029000      6.5800004E-02
 C    1.525200      0.7268000       1.056900    
 C  -0.6988000      0.2206000      0.1352000    
 C    1.086300      -1.684000      0.3897000    
 C    2.396800       1.236200     -0.9948000    
 C    1.149600     -0.4658000      -2.419800    
 C   -1.403400      9.2399999E-02   1.331100    
 C   -1.330500      0.7296000     -0.9982000    
 C   0.1343000      -2.663500      0.1118000    
 C    2.308300      -2.037600      0.9592000    
 C    3.229700       2.556000      0.8876000    
 C   -2.743500      0.4744000       1.393600    
 C   -2.670600       1.111600     -0.9357000    
 C    1.859800      5.2000001E-02  -3.644100    
 C   0.4052000      -4.000200      0.4040000    
 C    2.579300      -3.374300       1.251500    
 C   -3.377000      0.9839000      0.2602000    
 C    1.627700      -4.355600      0.9739000    
 C    2.779400       3.168100       2.189800    
 C   -5.590600      0.3309000      1.2900000E-02
 C   -6.997800      0.8416000      0.1080000    
 H  -0.9428000     -0.3229000       2.222400    
 H  -0.8312000      0.8953000      -1.943600    
 H  -0.8247000      -2.422600     -0.3367000    
 H    3.079800      -1.303300       1.170200    
 H   -3.289400      0.3683000       2.327100    
 H   -3.156200       1.517400      -1.819100    
 H    1.612100       1.103500      -3.809700    
 H    1.530700     -0.5156000      -4.520300    
 H    2.939400     -8.2800001E-02  -3.541400    
 H  -0.3349000      -4.764700      0.1865000    
 H    3.533000      -3.652000       1.690900    
 H    1.839200      -5.396500       1.200000    
 H    1.694700       3.304500       2.201800    
 H    3.242100       4.153000       2.303400    
 H    3.088200       2.531900       3.022900    
 H   -7.196600       1.187800       1.125200    
 H   -7.694400      3.2099999E-02 -0.1280000    
 H   -7.145800       1.651200     -0.6108000    


%chk=000151356-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151356

0 1
O 1.148814 0.640095 2.268200
O 2.990183 1.950556 -1.876723
O 0.485435 -1.406236 -2.612789
O 4.057119 3.087792 0.502944
O -4.816008 1.108671 -0.094960
O -5.697939 0.044839 1.817233
N 1.525781 0.164351 -1.262967
N 2.241807 1.599458 0.378381
C 0.802067 -0.292496 -0.026137
C 1.388355 0.679826 1.045147
C -0.709869 0.017387 -0.072547
C 1.166134 -1.752366 0.323194
C 2.344882 1.299899 -1.037433
C 1.367348 -0.516837 -2.515671
C -1.535030 -0.430286 0.987625
C -1.278740 0.830313 -1.081845
C 0.303205 -2.823391 -0.009864
C 2.417006 -2.036226 0.926829
C 2.992150 2.690727 1.012116
C -2.907218 -0.108656 1.041991
C -2.645703 1.161167 -1.046658
C 2.292950 -0.142609 -3.653974
C 0.677754 -4.153375 0.274959
C 2.794006 -3.366783 1.207226
C -3.455403 0.689386 0.009704
C 1.922314 -4.431485 0.884376
C 2.373215 3.266660 2.266044
C -5.849861 0.759571 0.807620
C -7.138877 1.392128 0.334711
H -1.102125 -1.029345 1.794621
H -0.668588 1.201136 -1.910545
H -0.648019 -2.619029 -0.507279
H 3.104135 -1.223221 1.192086
H -3.529887 -0.465027 1.862316
H -3.099669 1.777153 -1.828132
H 2.105162 0.886707 -4.004608
H 2.113584 -0.855774 -4.472355
H 3.351802 -0.170029 -3.345873
H 0.001571 -4.973006 0.009200
H 3.760811 -3.570808 1.679956
H 2.210984 -5.465308 1.104083
H 1.305599 3.503432 2.115368
H 2.933027 4.173728 2.537531
H 2.414569 2.536239 3.092615
H -7.019154 2.485906 0.250896
H -7.945760 1.156309 1.042936
H -7.400519 1.013359 -0.668648


