%chk=000126857.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126857

0 1
 O    1.475200     -0.1291000       1.031800    
 O    4.291600       2.021900      0.4833000    
 O   -1.363800     -0.5125000      -1.768900    
 O   -4.791400      0.8085000       1.512200    
 N    4.013400     -0.2585000      0.2021000    
 N   0.8483000      0.9087000     -0.9555000    
 N   -2.489500      0.2369000      0.1168000    
 N   -5.988100     -0.4535000     -2.4100000E-02
 C    2.979500     -0.1752000     -0.8213000    
 C    2.911500      -1.576100      -1.418000    
 C    3.337900      -2.476000     -0.2607000    
 C    4.391200      -1.646100      0.4577000    
 C    1.702600      0.1979000     -0.1300000    
 C    4.639000      0.8641000      0.7217000    
 C  -0.4566000       1.366600     -0.5362000    
 C    5.804900      0.5921000       1.638500    
 C   -1.456900      0.2514000     -0.8104000    
 C  -0.8540000       2.643500      -1.260300    
 C   -3.586200     -0.7004000      4.7699999E-02
 C   -3.278900      -1.970000      0.8263000    
 C   -4.828500     -1.2000000E-02  0.5976000    
 C   -7.301100      1.7899999E-02  0.3498000    
 H    3.253100      0.5826000      -1.563600    
 H    1.924200      -1.843100      -1.807100    
 H    3.639000      -1.667700      -2.233800    
 H    3.722000      -3.444200     -0.5939000    
 H    2.485200      -2.661000      0.4032000    
 H    5.385200      -1.810800      2.8000001E-02
 H    4.428000      -1.847400       1.531800    
 H    1.109700       1.052500      -1.926900    
 H  -0.4154000       1.560000      0.5425000    
 H    6.566600      3.1999999E-03   1.121200    
 H    5.463800      6.2799998E-02   2.532000    
 H    6.254600       1.540400       1.947400    
 H  -0.9104000       2.485200      -2.343400    
 H   -1.836200       2.994200     -0.9263000    
 H  -0.1240000       3.439100      -1.077300    
 H   -3.749500     -0.9570000      -1.005900    
 H   -2.476600      0.9035000      0.8837000    
 H   -2.383900      -2.464700      0.4345000    
 H   -4.113500      -2.676800      0.7700000    
 H   -3.101100      -1.751600       1.885500    
 H   -5.931000      -1.172000     -0.7395000    
 H   -7.247100       1.032600      0.7522000    
 H   -7.940700     -3.0000001E-04 -0.5356000    
 H   -7.704700     -0.6569000       1.108900    


%chk=000126857-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126857

0 1
O 0.162184 -0.724357 1.058446
O 3.396598 1.090987 -1.557274
O -2.054532 2.139488 -1.757268
O -3.675809 -1.456230 1.276984
N 3.492712 -0.545819 0.082026
N 0.830447 0.897831 -0.474147
N -2.219396 0.408800 -0.208064
N -5.642307 -0.673532 0.294196
C 2.184539 -1.155547 -0.320295
C 2.217789 -2.542737 0.353998
C 3.049972 -2.298986 1.638797
C 4.147196 -1.308239 1.183851
C 0.969370 -0.307522 0.158886
C 4.042148 0.507559 -0.612942
C -0.226996 1.861894 -0.091657
C 5.437814 0.959255 -0.206063
C -1.579760 1.488449 -0.772299
C 0.195509 3.289585 -0.462706
C -3.491680 -0.079402 -0.754421
C -3.268852 -1.055070 -1.943891
C -4.266063 -0.788158 0.374172
C -6.544501 -1.351157 1.233514
H 2.151052 -1.204721 -1.424813
H 1.200236 -2.892482 0.584887
H 2.718057 -3.272360 -0.308464
H 3.479944 -3.224202 2.056446
H 2.405358 -1.834035 2.404143
H 5.039052 -1.844036 0.800592
H 4.472917 -0.632343 1.994569
H 1.572300 1.169299 -1.149751
H -0.368578 1.764703 1.002851
H 6.152578 0.117541 -0.168079
H 5.422912 1.431139 0.794267
H 5.786709 1.700245 -0.939694
H 0.264876 3.402464 -1.557697
H -0.558157 4.011903 -0.107968
H 1.169674 3.534995 -0.004530
H -4.047463 0.803210 -1.125061
H -1.757776 -0.138975 0.538523
H -2.692532 -0.539950 -2.730816
H -4.231526 -1.387893 -2.373660
H -2.708525 -1.944013 -1.605746
H -6.041845 -0.081108 -0.435272
H -5.916705 -1.919247 1.938559
H -7.151556 -0.623350 1.802664
H -7.219984 -2.051176 0.707906


