%chk=000082000.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082000

0 1
 O   -1.627300      0.8756000      0.6981000    
 O  -0.3705000     -0.7443000     -0.4839000    
 O   -4.518900      -1.905700     -0.3776000    
 O   -4.511300      0.6471000      0.7097000    
 O   -1.939100      -2.776100      0.5515000    
 O   -1.564300       3.455900     -0.2070000    
 O    5.477600       1.349000      0.4158000    
 O    5.888700     -0.7592000     -3.7700001E-02
 N    5.087300      0.1929000      0.1230000    
 C   -3.348100      -1.101500     -0.4906000    
 C   -3.725500      0.3821000     -0.4549000    
 C   -2.396600      -1.432200      0.6593000    
 C   -2.461800       1.251000     -0.4088000    
 C   -1.193100     -0.4863000      0.6531000    
 C   -2.781600       2.733700     -0.2510000    
 C   0.9698000     -0.5143000     -0.3350000    
 C    1.419100      0.7617000     -9.2000002E-03
 C    1.873700      -1.557800     -0.5096000    
 C    2.785600      0.9967000      0.1430000    
 C    3.240200      -1.322700     -0.3572000    
 C    3.696000     -4.5400001E-02 -3.0900000E-02
 H   -2.882300      -1.347300      -1.452600    
 H   -4.348800      0.6341000      -1.319400    
 H   -2.936400      -1.353400       1.610500    
 H   -1.878800       1.120000      -1.329400    
 H  -0.6137000     -0.6775000       1.566400    
 H   -3.317900       2.942700      0.6801000    
 H   -3.377500       3.102100      -1.091100    
 H   -4.234200      -2.835600     -0.3750000    
 H   -3.928900      0.6138000       1.487200    
 H   -1.333300      -2.940700       1.294100    
 H   -1.062200       3.137400      0.5624000    
 H   0.7320000       1.591800      0.1131000    
 H    1.522300      -2.554100     -0.7631000    
 H    3.105000       2.005100      0.3933000    
 H    3.920200      -2.158600     -0.5003000    


%chk=000082000-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000082000

0 1
O -1.670763 0.880217 0.752859
O -0.373546 -0.978731 -0.095733
O -4.575883 -1.967323 -0.376874
O -4.591280 0.819036 0.549053
O -2.232803 -2.852978 0.919678
O -1.251148 3.300045 -0.761449
O 5.547630 1.325238 0.689285
O 5.881531 -0.217282 -0.960340
N 5.123132 0.416149 -0.126667
C -3.354895 -1.179401 -0.381040
C -3.714469 0.320970 -0.515516
C -2.542396 -1.423030 0.906492
C -2.395157 1.119924 -0.555183
C -1.288115 -0.514602 0.946106
C -2.551920 2.638609 -0.645811
C 0.967747 -0.567059 -0.048299
C 1.462484 0.444533 0.816608
C 1.831402 -1.240635 -0.948487
C 2.833137 0.761577 0.790895
C 3.196160 -0.918227 -0.980625
C 3.685248 0.078645 -0.103349
H -2.709696 -1.459086 -1.243125
H -4.294640 0.466174 -1.442742
H -3.170818 -1.153469 1.782314
H -1.740478 0.767869 -1.374571
H -0.785024 -0.537088 1.931470
H -3.131375 3.015251 0.220384
H -3.096479 2.896688 -1.569277
H -4.314080 -2.906949 -0.190229
H -4.043958 0.943237 1.368560
H -1.967516 -3.143896 1.827420
H -0.711177 3.051092 0.031851
H 0.791957 0.995744 1.480838
H 1.413187 -2.013296 -1.599386
H 3.251403 1.534370 1.441148
H 3.888000 -1.422316 -1.659957


