%chk=000070091.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070091

0 1
 O  -0.1799000     -0.7597000     -3.0000001E-04
 O   0.9009000       1.266600      9.9999997E-05
 N    2.066600     -0.7396000     -9.9999997E-05
 N    3.304600     -0.1324000      3.0000001E-04
 C   -1.437800     -8.3499998E-02  9.9999997E-05
 C   -1.523200      0.7849000      -1.254300    
 C   -2.532500      -1.148200     -8.0000004E-03
 C   -1.529800      0.7722000       1.262500    
 C   0.9310000      3.9700001E-02 -3.0000001E-04
 H   -1.174000      0.2362000      -2.136700    
 H   -2.560600       1.089000      -1.438000    
 H  -0.9508000       1.714500      -1.204600    
 H   -2.443500      -1.803400      0.8663000    
 H   -2.440000      -1.793600     -0.8890000    
 H   -3.533400     -0.7045000     -7.4999998E-03
 H  -0.9427000       1.693500       1.232300    
 H   -2.565700       1.087800       1.435700    
 H   -1.199500      0.2086000       2.142800    
 H    2.020600      -1.753000     -1.9999999E-04
 H    3.807100     -0.4841000     -0.8136000    
 H    3.806600     -0.4843000      0.8144000    


%chk=000070091-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070091

0 1
O -0.149004 -0.766213 -0.003467
O 1.206487 1.195465 0.002910
N 2.101777 -0.970787 0.001205
N 3.457346 -0.574801 0.004938
C -1.478489 -0.023143 -0.001483
C -1.587833 0.831294 -1.280400
C -2.489279 -1.183176 -0.007858
C -1.591633 0.820102 1.284606
C 1.055330 -0.055287 0.000014
H -1.449152 0.201953 -2.177575
H -2.592668 1.288953 -1.332476
H -0.832391 1.632716 -1.282935
H -2.357503 -1.817302 0.885633
H -2.353751 -1.810527 -0.905566
H -3.519356 -0.784151 -0.008503
H -0.837711 1.622834 1.295752
H -2.597441 1.275414 1.338848
H -1.453537 0.183181 2.176512
H 1.905089 -1.971147 -0.001184
H 3.695743 -0.042738 -0.842161
H 3.691975 -0.045941 0.855090


