%chk=000160421.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160421

0 1
 O   -1.563200      0.5657000      1.1000000E-03
 O    3.044300      0.5988000       0.000000    
 O   -4.892400     -0.4968000     -2.0000001E-03
 O   -3.996700       1.512100      1.5000000E-03
 O    4.163800      -1.429300      1.0000000E-03
 N   -3.872100      0.2524000     -3.9999999E-04
 N   0.7974000       1.898900     -1.8000000E-03
 N    1.900500     -0.2125000      1.3000000E-03
 C  -0.4882000     -0.2094000      6.9999998E-04
 C  -0.7165000      -1.516300     -3.9999999E-04
 C   -2.597000     -0.3161000      1.9999999E-04
 C   -2.128700      -1.609400     -6.9999998E-04
 C   0.8206000      0.5202000      1.6000000E-03
 C    4.147300     -0.2052000     -3.9999999E-04
 C    5.380800      0.6470000     -1.8000000E-03
 H  -7.4999998E-03  -2.331300     -8.9999998E-04
 H   -2.725000      -2.511100     -1.7000000E-03
 H  -7.3399998E-02   2.419700     -3.3000000E-03
 H    1.658600       2.434700     -3.4000000E-03
 H    5.400800       1.269000     -0.9001000    
 H    6.265700      4.1000000E-03 -3.8999999E-03
 H    5.403800       1.267600      0.8975000    


%chk=000160421-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000160421

0 1
O -1.586365 0.598685 -0.000733
O 3.105222 0.503943 -0.002872
O -4.988150 -0.526753 0.001363
O -4.102016 1.599314 0.000259
O 4.393828 -1.477551 -0.000816
N -3.994693 0.309892 0.000429
N 0.850259 1.831409 -0.002313
N 1.902032 -0.364175 -0.001920
C -0.448309 -0.230365 -0.000959
C -0.832957 -1.572442 -0.000306
C -2.685070 -0.271322 0.000052
C -2.265652 -1.598951 0.000327
C 0.842938 0.457974 -0.001779
C 4.330286 -0.243048 -0.003007
C 5.474497 0.750678 -0.000350
H -0.148456 -2.416857 -0.000312
H -2.919376 -2.467051 0.000915
H -0.022975 2.354456 -0.002129
H 1.745257 2.314346 -0.002845
H 5.423669 1.400988 -0.890684
H 6.426923 0.201473 -0.000211
H 5.422010 1.398156 0.891990


