%chk=000125989.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125989

0 1
 O  -0.9549000       1.260800      -1.064200    
 O    2.324700      0.3002000      -1.339300    
 O    3.041700     -0.7103000      0.5573000    
 O   -3.471200     -0.8797000     -0.5320000    
 O  -0.1321000       3.425700      0.3059000    
 N   0.9062000      -2.456300      0.3444000    
 N   4.9999999E-03   2.136800      0.8381000    
 C  -0.2468000     -0.2832000      0.6427000    
 C   0.7537000      -1.104200     -0.2046000    
 C   -1.580800     -0.9800000      0.9583000    
 C  -0.4499000       1.112900      4.8999999E-02
 C    2.153200     -0.5079000     -0.2611000    
 C   -2.348800      -1.314800     -0.2944000    
 H   0.2320000     -0.1333000       1.623200    
 H   0.3923000      -1.205000      -1.234900    
 H   -2.207400     -0.3211000       1.571400    
 H   -1.430100      -1.906200       1.521800    
 H    1.282200      -2.408400       1.290500    
 H    1.576900      -2.984800     -0.2119000    
 H   -1.860800      -2.014900     -0.9925000    
 H   0.5077000       2.047700       1.714000    
 H    3.227000      0.6840000      -1.368700    
 H   0.6913000       3.833800      0.6229000    


%chk=000125989-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125989

0 1
O -1.451815 1.508920 -0.423434
O 2.903530 -0.563769 -1.243209
O 2.624471 0.388296 0.854796
O -3.644059 -1.221723 -0.414234
O 0.113423 3.485885 0.439607
N 0.973948 -2.398557 0.251125
N 0.321864 2.132555 0.874800
C -0.232731 -0.281207 0.801436
C 0.790936 -0.990407 -0.142411
C -1.577506 -1.042157 0.876584
C -0.493643 1.164215 0.361653
C 2.158100 -0.282791 -0.101095
C -2.403922 -1.041518 -0.407927
H 0.220013 -0.266583 1.813046
H 0.428930 -0.970277 -1.184104
H -2.210673 -0.649490 1.691673
H -1.350059 -2.102925 1.106514
H 1.391506 -2.540571 1.176058
H 1.371931 -3.002711 -0.472026
H -1.838582 -0.946468 -1.366882
H 1.221014 1.990092 1.343175
H 3.811305 -0.159934 -1.169604
H -0.716881 3.382924 -0.129641


