%chk=000093297.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093297

0 1
 O  -0.8331000      -2.173300      0.6641000    
 O   -1.508300       2.396700      0.3107000    
 O    5.186700      0.2157000     -0.5667000    
 O    4.413700      -1.811300     -0.2307000    
 N   -1.587300      5.6600001E-02  0.5763000    
 N    4.240500     -0.5728000     -0.3289000    
 C   -3.000100     -0.1322000      0.8392000    
 C   -3.816100     -0.2759000     -0.4412000    
 C   0.6173000     -0.3452000      0.2491000    
 C   0.4147000       1.022900      0.1427000    
 C  -0.6736000     -0.9748000      0.5253000    
 C   -1.008600       1.287600      0.3496000    
 C   -5.312100     -0.4480000     -0.1688000    
 C    1.866300     -0.9121000      9.9399999E-02
 C    1.450300       1.896200     -0.1187000    
 C    2.931100     -4.6300001E-02 -0.1652000    
 C   -6.106500     -0.5282000      -1.463100    
 C    2.725200       1.344400     -0.2731000    
 H   -3.123400      -1.027700       1.458800    
 H   -3.359800      0.7322000       1.409200    
 H   -3.446500      -1.134200      -1.016400    
 H   -3.659800      0.6085000      -1.072100    
 H   -5.680700      0.3953000      0.4266000    
 H   -5.479800      -1.358500      0.4179000    
 H    1.988300      -1.986200      0.1882000    
 H    1.291700       2.965000     -0.2022000    
 H   -5.780900      -1.378400      -2.070900    
 H   -7.172000     -0.6534000      -1.246600    
 H   -5.985200      0.3845000      -2.055300    
 H    3.547000       2.026600     -0.4791000    


%chk=000093297-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093297

0 1
O -0.933770 -2.213434 0.725859
O -1.599731 2.437753 0.378416
O 5.310666 0.238174 -0.604639
O 4.498440 -1.863867 -0.249649
N -1.609426 0.067600 0.614642
N 4.351958 -0.587296 -0.353866
C -3.051357 -0.121769 0.850934
C -3.856509 -0.250764 -0.462644
C 0.655718 -0.351276 0.262049
C 0.454790 1.047113 0.157543
C -0.666665 -1.000378 0.555805
C -1.003201 1.333726 0.381718
C -5.363998 -0.449817 -0.187132
C 1.920619 -0.927356 0.101508
C 1.514924 1.925252 -0.113166
C 2.981477 -0.029534 -0.172379
C -6.188536 -0.564623 -1.486850
C 2.805545 1.370058 -0.281910
H -3.164668 -1.035484 1.461337
H -3.409000 0.746627 1.433185
H -3.468077 -1.107675 -1.046570
H -3.707071 0.660745 -1.072969
H -5.742243 0.399806 0.416937
H -5.508714 -1.362199 0.426148
H 2.096474 -2.003147 0.179796
H 1.344323 3.002835 -0.190445
H -5.851682 -1.423408 -2.097027
H -7.262595 -0.706017 -1.269128
H -6.085598 0.347644 -2.103494
H 3.676908 1.994412 -0.495910


