%chk=000097340.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097340

0 1
 O   0.9049000      -2.843300      3.1999999E-03
 O    2.608200      -1.458500      8.9999998E-04
 O   -3.987400      0.9593000       0.000000    
 O   -3.598000      -1.201100     -3.9999999E-04
 N    2.333800       1.013700     -6.9999998E-04
 N    1.374900      -1.681400      1.4000000E-03
 N   -3.194500     -1.3100000E-02 -9.9999997E-05
 C   0.9482000      0.7356000     -7.9999998E-04
 C   0.4771000     -0.5774000     -6.0000003E-04
 C   4.6900000E-02   1.800100     -6.9999998E-04
 C  -0.8956000     -0.8258000     -3.0000001E-04
 C   -1.796900      0.2388000     -3.0000001E-04
 C   -1.325600       1.551700     -5.0000002E-04
 C    3.050500       1.157500       1.249200    
 C    3.053400       1.144100      -1.250500    
 H   0.4021000       2.827500     -7.9999998E-04
 H   -1.267500      -1.847800      9.9999997E-05
 H   -1.998200       2.405600     -3.9999999E-04
 H    2.910800       2.168900       1.645100    
 H    4.125600      0.9918000       1.122900    
 H    2.694900      0.4467000       2.003500    
 H    4.120800      0.9323000      -1.128300    
 H    2.954100       2.165500      -1.632800    
 H    2.668200      0.4584000      -2.013500    


%chk=000097340-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000097340

0 1
O 0.867777 -2.672580 -1.371104
O 2.391681 -1.929038 0.158593
O -4.017493 0.876206 0.506078
O -3.663898 -1.138501 -0.516368
N 2.358472 1.025141 0.050882
N 1.304820 -1.785829 -0.536755
N -3.240627 -0.042130 0.023973
C 1.029362 0.668198 0.166138
C 0.476806 -0.589349 -0.291786
C 0.080550 1.611372 0.702324
C -0.913318 -0.803646 -0.375522
C -1.790581 0.183715 0.095104
C -1.293477 1.382913 0.669968
C 2.895849 2.171063 0.811297
C 3.279541 0.426042 -0.932089
H 0.441280 2.565686 1.092197
H -1.296877 -1.753107 -0.758150
H -2.002759 2.122231 1.051125
H 2.686805 3.139443 0.313307
H 3.988009 2.053596 0.896108
H 2.482603 2.194335 1.833066
H 3.898244 -0.372879 -0.485388
H 3.930779 1.223535 -1.331567
H 2.717151 -0.007319 -1.775834


