%chk=000097591.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097591

0 1
 O   4.0100001E-02  -1.130300      -1.291700    
 O    1.951400       1.506700      0.2454000    
 O   -2.270700       1.484300      0.7286000    
 O    4.001400      0.9086000     -0.5212000    
 N    1.157400     -0.9333000      0.7368000    
 N   -2.347600     -0.7340000      2.2000000E-02
 C   -1.224100      -1.223200      0.7649000    
 C   3.4000002E-02  -1.078200     -6.4400002E-02
 C    2.498800     -0.8241000      0.2094000    
 C   -2.781900      0.5866000      6.4300001E-02
 C    2.907600      0.6003000     -6.4000003E-02
 C   -3.966500      0.8366000     -0.8300000    
 H   -1.140700     -0.6689000       1.705200    
 H   -1.385700      -2.283200      0.9812000    
 H    1.048300     -0.8986000       1.746000    
 H    2.564500      -1.390600     -0.7242000    
 H    3.176600      -1.245500      0.9568000    
 H   -2.832100      -1.389400     -0.5848000    
 H   -4.435500       1.787300     -0.5618000    
 H   -3.632700      0.8786000      -1.870200    
 H   -4.706000      3.8800001E-02 -0.7168000    
 H    2.241700       2.425000      5.9000000E-02


%chk=000097591-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097591

0 1
O -0.112612 -1.157318 -1.282902
O 3.475034 0.618616 1.460081
O -3.744693 1.029424 1.195681
O 4.906276 -0.562530 0.053523
N 1.268042 -0.104149 0.254083
N -2.381443 -0.174049 -0.234224
C -1.162669 0.241618 0.448983
C 0.033230 -0.401118 -0.269940
C 2.483931 -0.657281 -0.345066
C -3.620970 0.255867 0.193210
C 3.750709 -0.225504 0.371137
C -4.814444 -0.253555 -0.608596
H -1.070633 1.346450 0.447852
H -1.187510 -0.063963 1.514455
H 1.376113 0.503239 1.069888
H 2.571973 -0.360102 -1.408295
H 2.453000 -1.764203 -0.353088
H -2.245896 -0.796909 -1.038662
H -5.497402 -0.796838 0.067009
H -5.372698 0.608676 -1.012326
H -4.529937 -0.918762 -1.441640
H 4.320899 0.885891 1.909337


