%chk=000168013.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168013

0 1
 O   -2.037500      -3.509400      3.0000001E-04
 O   -2.036500       3.509700      9.9999997E-05
 O  -0.1021000      -2.467600      9.9999997E-05
 O  -0.1014000       2.467300     -9.9999997E-05
 O    4.936900     -3.0000001E-04  -1.099100    
 O    4.936900     -9.9999997E-05   1.099000    
 N   -1.353000      -2.462300       0.000000    
 N   -1.352400       2.462400      9.9999997E-05
 N    4.334600     -9.9999997E-05   0.000000    
 C   -1.321800      9.9999997E-05   0.000000    
 C   0.1250000     -1.9999999E-04 -9.9999997E-05
 C   -2.028200      -1.207800     -9.9999997E-05
 C   -2.028000       1.208100       0.000000    
 C   0.8223000     -1.9999999E-04  -1.208100    
 C   0.8224000     -9.9999997E-05   1.208000    
 C   -3.423100      -1.207700     -9.9999997E-05
 C   -3.422800       1.208200      9.9999997E-05
 C   -4.120500      3.0000001E-04   0.000000    
 C    2.217200     -1.9999999E-04  -1.208000    
 C    2.217300       0.000000       1.208000    
 C    2.914700       0.000000       0.000000    
 H   0.2938000     -1.9999999E-04  -2.158600    
 H   0.2938000       0.000000       2.158500    
 H   -4.006400      -2.125000     -9.9999997E-05
 H   -4.005900       2.125700      9.9999997E-05
 H   -5.206700      5.0000002E-04   0.000000    
 H    2.726600     -1.9999999E-04  -2.168300    
 H    2.726600      9.9999997E-05   2.168200    


%chk=000168013-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168013

0 1
O -2.236402 -3.581841 0.000877
O -2.236149 3.582232 -0.000136
O -0.166718 -2.646812 0.000482
O -0.166503 2.647118 -0.000578
O 5.072110 -0.000421 -1.140704
O 5.072090 -0.000661 1.140670
N -1.447864 -2.559654 -0.000202
N -1.447649 2.560018 0.000111
N 4.466333 -0.000363 -0.000023
C -1.320657 0.000160 -0.000067
C 0.185604 0.000046 -0.000061
C -2.094698 -1.200474 -0.000110
C -2.094571 1.200883 0.000030
C 0.894530 0.000093 -1.227175
C 0.894507 -0.000166 1.227066
C -3.507816 -1.213280 -0.000067
C -3.507687 1.213833 0.000052
C -4.216394 0.000314 0.000002
C 2.300094 -0.000039 -1.234755
C 2.300074 -0.000300 1.234670
C 2.983676 -0.000231 -0.000035
H 0.348143 0.000238 -2.175638
H 0.348105 -0.000218 2.175522
H -4.017615 -2.179639 -0.000100
H -4.017383 2.180247 0.000125
H -5.309726 0.000371 0.000021
H 2.872200 0.000000 -2.165949
H 2.872166 -0.000456 2.165872


