%chk=000128030.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128030

0 1
 O    1.206200      -1.147300       1.753000    
 N  -0.3283000      0.5153000       1.225600    
 N   -6.626700      -1.967300     -0.4953000    
 N   -4.826300       3.108300      -1.861800    
 C   -3.001900      0.9721000      0.1972000    
 C   -1.776800       1.695400     -0.3828000    
 C   -2.584500     -0.3779000      0.8000000    
 C  -0.6649000       1.825700      0.6568000    
 C   -1.458100     -0.2041000       1.816200    
 C   -4.076400      0.7815000     -0.8705000    
 C   0.9490000     -4.2199999E-02   1.268600    
 C   -5.265100     -7.1999999E-03 -0.3499000    
 C    2.065400      0.7797000      0.6752000    
 C    3.386900     -9.3000000E-03  0.7082000    
 C   -4.498700       2.083800      -1.425600    
 C   -6.018300      0.4920000      0.6861000    
 C    4.594800      0.8207000      0.2871000    
 C    3.314200      -1.318200     -7.0600003E-02
 C   -5.583600      -1.215000     -0.9121000    
 C   -7.099900     -0.2531000       1.142600    
 C    5.827500      0.5201000      0.8262000    
 C    4.094200      -2.378700      0.3387000    
 C    4.414500       1.843800     -0.6191000    
 C    2.470900      -1.398200      -1.158200    
 C   -7.359700      -1.465300      0.5238000    
 C    6.932500       1.279100      0.4410000    
 C    4.027700      -3.576200     -0.3735000    
 C    5.519700       2.602700      -1.004300    
 C    2.404300      -2.595800      -1.870300    
 C    6.778700       2.320300     -0.4742000    
 C    3.182700      -3.684800      -1.477800    
 H   -3.393200       1.597700       1.013000    
 H   -1.392500       1.139400      -1.248100    
 H   -2.036400       2.700600     -0.7320000    
 H   -3.419600     -0.8701000       1.309100    
 H   -2.245700      -1.051200      1.7000000E-03
 H   0.1965000       2.322900      0.2097000    
 H  -0.9981000       2.458700       1.488300    
 H   -1.804000      0.3791000       2.677800    
 H   -1.143800      -1.183800       2.189800    
 H   -3.631000      0.2160000      -1.702300    
 H    2.167700       1.687100       1.285000    
 H    1.780100       1.087400     -0.3334000    
 H    3.547000     -0.2688000       1.767400    
 H   -5.796500       1.446000       1.153900    
 H   -5.014200      -1.644200      -1.729400    
 H   -7.720200      0.1038000       1.956600    
 H    5.961100     -0.2782000       1.548800    
 H    4.745800      -2.314000       1.203800    
 H    3.460200       2.084600      -1.071200    
 H    1.868800     -0.5747000      -1.520900    
 H   -8.191700      -2.084500      0.8426000    
 H    7.912400       1.061200      0.8556000    
 H    4.631500      -4.425100     -6.6299997E-02
 H    5.401500       3.410600      -1.720600    
 H    1.751300      -2.679000      -2.734300    
 H    7.639200       2.910900     -0.7747000    
 H    3.131500      -4.616900      -2.032900    


%chk=000128030-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128030

0 1
O 1.217440 0.217355 3.098750
N -0.184601 1.440556 1.708165
N -5.377699 -3.063890 0.610100
N -3.729184 0.940108 -3.221229
C -2.509439 0.656564 0.086520
C -1.265541 1.345421 -0.532507
C -2.128329 -0.076581 1.398131
C -0.533126 2.226746 0.506776
C -1.376023 0.860486 2.371698
C -3.159555 -0.342779 -0.946473
C 1.076951 1.012105 2.109482
C -4.405530 -1.045467 -0.398106
C 2.327733 1.495293 1.366637
C 3.169431 0.271558 0.886718
C -3.472501 0.357059 -2.212090
C -5.657065 -0.388541 -0.302790
C 4.561133 0.659324 0.367320
C 2.373413 -0.553246 -0.139706
C -4.327359 -2.381530 0.068394
C -6.755713 -1.077261 0.253771
C 5.498326 -0.376299 0.104673
C 1.628431 -1.685549 0.279979
C 4.962983 1.998170 0.133639
C 2.332159 -0.182133 -1.509163
C -6.571976 -2.407376 0.698696
C 6.793209 -0.085705 -0.371836
C 0.859350 -2.429129 -0.645573
C 6.260902 2.295382 -0.346070
C 1.560303 -0.919077 -2.435167
C 7.181567 1.256229 -0.601258
C 0.819790 -2.047228 -2.007201
H -3.266368 1.434965 0.323609
H -0.561935 0.576575 -0.906526
H -1.562760 1.972442 -1.394439
H -3.031013 -0.470251 1.900131
H -1.473253 -0.939736 1.165512
H 0.364000 2.674504 0.056216
H -1.194080 3.062292 0.818963
H -2.038034 1.687649 2.699851
H -1.029098 0.308721 3.259224
H -2.390902 -1.110797 -1.175574
H 2.927890 2.070057 2.097917
H 2.107107 2.159605 0.515974
H 3.303411 -0.361423 1.785726
H -5.774272 0.636115 -0.674576
H -3.382485 -2.936924 0.005242
H -7.737380 -0.600719 0.336648
H 5.202650 -1.419065 0.274262
H 1.651078 -1.977049 1.336826
H 4.272315 2.825366 0.328776
H 2.926420 0.672797 -1.854005
H -7.399963 -2.977147 1.134918
H 7.499543 -0.901541 -0.562952
H 0.306733 -3.313490 -0.306690
H 6.550837 3.338518 -0.517159
H 1.544238 -0.622877 -3.490224
H 8.187160 1.485758 -0.970916
H 0.236385 -2.629511 -2.729716


