%chk=000152475.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152475

0 1
 O  -0.6314000     -4.2399999E-02 -0.3956000    
 O   -2.227100       2.150600       1.019800    
 O   -2.221800      -1.607400       2.472600    
 O    2.693900       2.385300     -0.6140000    
 O    5.184000      -1.475100     -0.3238000    
 N    1.650300      0.3812000     -8.2400002E-02
 N   -3.011500      -1.480400     -0.9419000    
 N   -3.219300      0.8016000     -0.9493000    
 N    1.742200     -0.9678000      0.1463000    
 N   -3.225000      -1.060400      -2.100100    
 N   -3.352800      0.3425000      -2.104600    
 N    3.976300      0.5068000     -0.4862000    
 C   -1.639800     -0.1996000      0.6248000    
 C   -1.503800       1.032400       1.527300    
 C  -2.1299999E-02   1.332000       1.460800    
 C   0.3309000      0.9323000      3.4899998E-02
 C   -2.999400     -0.3258000     -5.9900001E-02
 C   -1.322100      -1.493600       1.386100    
 C    2.762100       1.170900     -0.4072000    
 C    2.889200      -1.547600      6.3500002E-02
 C    4.146400     -0.8354000     -0.2712000    
 H   -1.851100      0.8666000       2.551100    
 H   0.2338000       2.378400       1.656800    
 H   0.5198000      0.7143000       2.187600    
 H   0.2342000       1.797300     -0.6315000    
 H   -3.815400     -0.3960000      0.6680000    
 H  -0.3055000      -1.483200       1.790500    
 H   -1.392100      -2.384100      0.7528000    
 H   -2.051700       2.904100       1.608900    
 H   -1.999200      -2.427400       2.945400    
 H    4.798100       1.056500     -0.7196000    
 H    2.989100      -2.629500      0.2429000    


%chk=000152475-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152475

0 1
O -0.386753 -0.319919 -0.055169
O -2.211953 2.001629 1.440709
O -2.993162 -1.890119 2.107391
O 2.050891 1.817914 -1.843366
O 5.605415 -0.993174 -0.630240
N 1.859979 0.459375 0.084367
N -3.452570 -1.308176 -0.695558
N -2.521624 0.805574 -1.340141
N 2.378517 -0.474914 0.962966
N -3.555613 -1.413157 -1.919536
N -2.772788 0.356978 -2.455519
N 3.823397 0.410461 -1.233673
C -1.609527 -0.286791 0.778273
C -1.405754 0.840902 1.844310
C 0.110321 1.125780 1.783681
C 0.465290 0.843464 0.314381
C -2.847577 -0.016614 -0.127625
C -1.707008 -1.685932 1.448126
C 2.539552 0.962568 -1.070032
C 3.592270 -0.945050 0.741374
C 4.449764 -0.552565 -0.398407
H -1.731448 0.480733 2.838516
H 0.352197 2.158068 2.084869
H 0.664196 0.418509 2.424147
H 0.246430 1.686944 -0.361670
H -3.630509 0.508392 0.448277
H -0.941372 -1.758129 2.238598
H -1.498750 -2.455656 0.681161
H -2.187430 2.687483 2.152969
H -3.654038 -2.133554 1.405753
H 4.349222 0.742040 -2.050370
H 3.980433 -1.675964 1.454234


