%chk=000111081.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111081

0 1
 O    1.602200     -0.1783000     -0.9947000    
 O    3.806300       1.629300      0.1219000    
 O    2.339000      -2.842500     -0.5952000    
 O   -1.182900       2.802700     -0.3830000    
 O   -4.351500     -0.4692000      0.2323000    
 N  -0.4534000      0.5942000     -0.1868000    
 N   -2.751500       1.158500     -7.6399997E-02
 N   -2.453600      -2.464000      0.3168000    
 C    3.030800      0.5990000      0.7304000    
 C   0.9391000      0.9050000     -0.3275000    
 C    1.635500       1.108600       1.008200    
 C    2.794400     -0.5281000     -0.2653000    
 C    2.553700      -1.872900      0.4081000    
 C  -0.8210000     -0.7328000     -6.2000002E-03
 C   -1.435300       1.606100     -0.2278000    
 C   -2.080300      -1.165200      0.1394000    
 C   -3.171600     -0.1503000      0.1059000    
 H    3.561700      0.2748000       1.630400    
 H    1.059200       1.796100     -0.9550000    
 H    1.170100      0.4999000       1.792900    
 H    1.595600       2.155100       1.326400    
 H    3.604300     -0.6118000     -0.9985000    
 H    1.705000      -1.873900       1.095600    
 H    3.438600      -2.172800      0.9786000    
 H    3.885000       2.353200      0.7665000    
 H  -3.6200002E-02  -1.470800      1.5200000E-02
 H   -3.477100       1.869600     -0.1026000    
 H    1.591100      -2.547900      -1.141900    
 H   -3.433000      -2.698700      0.4187000    
 H   -1.751400      -3.192600      0.3473000    


%chk=000111081-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000111081

0 1
O 1.597156 -0.229098 -0.921475
O 3.772143 1.734909 0.285464
O 2.618821 -2.803633 -0.948950
O -1.104192 2.711079 -0.856169
O -4.564553 -0.331670 -0.012153
N -0.541373 0.527938 -0.143146
N -2.795362 1.145579 -0.432577
N -2.810778 -2.340930 0.690753
C 3.060465 0.577725 0.848541
C 0.893299 0.848944 -0.187263
C 1.591658 0.910435 1.191399
C 2.942600 -0.444836 -0.301565
C 2.997395 -1.914168 0.145853
C -0.960037 -0.758296 0.258573
C -1.444250 1.542756 -0.509659
C -2.294083 -1.108015 0.323462
C -3.316687 -0.102146 -0.040256
H 3.610905 0.165363 1.718856
H 0.985479 1.800579 -0.736088
H 1.169133 0.145335 1.868521
H 1.474750 1.899540 1.664780
H 3.699002 -0.234198 -1.076651
H 2.333107 -2.066816 1.027758
H 4.027071 -2.194833 0.427013
H 3.805072 2.462941 0.956621
H -0.153961 -1.465357 0.462186
H -3.474230 1.866942 -0.695615
H 1.841406 -2.387971 -1.409041
H -3.825317 -2.440220 0.666136
H -2.221838 -3.137577 0.908391


