%chk=000232158.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232158

0 1
O -1.158421 1.689918 0.661816
O 4.421430 0.134578 -0.365132
O -2.145608 -3.448998 -0.539011
O 3.259862 -1.703202 0.273967
O -2.781562 -1.660669 0.687033
O -1.901794 0.982046 -1.373232
N 2.308753 1.805539 -0.208639
C 0.810266 0.184998 0.398996
C 0.194477 -1.116988 0.755524
C 0.154433 1.442882 0.318021
C 2.160507 0.432135 0.073141
C 1.082354 2.437160 -0.070963
C -0.591324 -1.704283 -0.426994
C 0.875372 3.878075 -0.298396
C 3.258246 -0.519451 0.026251
C -1.940883 -2.199670 0.000015
C -2.164481 1.322625 -0.249535
C -3.471141 1.423934 0.476874
C -4.551899 2.023151 -0.409214
C 5.616109 -0.684424 -0.460908
C -3.427558 -4.080887 -0.281588
H -0.472153 -0.975221 1.638553
H 0.980302 -1.840738 1.077506
H 3.184761 2.226832 -0.469077
H -0.747651 -0.931535 -1.226026
H -0.006242 -2.511254 -0.920003
H 1.623435 4.502899 0.210191
H 0.896416 4.127930 -1.371690
H -0.114953 4.188986 0.080827
H -3.357425 1.998785 1.421401
H -3.745060 0.382321 0.797657
H -4.350355 3.074813 -0.646499
H -5.531670 1.975744 0.082218
H -4.635215 1.481921 -1.363266
H 6.378040 0.037784 -0.770161
H 5.462974 -1.467622 -1.210633
H 5.838091 -1.124593 0.516762
H -4.186397 -3.600782 -0.906248
H -3.249298 -5.119303 -0.579820
H -3.686237 -3.997934 0.779278


%chk=000232158-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232158

0 1
O -1.159663 2.206238 0.724184
O 4.211893 -0.075926 -0.402473
O -1.664452 -3.780206 -0.926964
O 2.778969 -1.840515 0.191945
O -2.353944 -2.759656 1.047877
O -2.201908 1.068964 -1.048713
N 2.276164 1.781965 -0.225448
C 0.598936 0.382190 0.446625
C -0.186392 -0.834993 0.860780
C 0.126432 1.728235 0.361165
C 1.961945 0.444418 0.065631
C 1.165179 2.587927 -0.053236
C -0.596057 -1.709938 -0.351669
C 1.157539 4.068220 -0.284392
C 2.953268 -0.612479 -0.023018
C -1.615294 -2.763910 0.034541
C -2.290189 1.784842 -0.034776
C -3.554479 2.326157 0.605741
C -4.781135 2.227255 -0.319364
C 5.300950 -1.066541 -0.533222
C -2.668945 -4.842631 -0.683929
H -1.097419 -0.529842 1.405490
H 0.415550 -1.452778 1.550735
H 3.209197 2.075506 -0.513072
H -1.054327 -1.070816 -1.131127
H 0.285114 -2.199845 -0.799240
H 1.949951 4.581069 0.292478
H 1.300142 4.320614 -1.352478
H 0.187366 4.483344 0.032557
H -3.363993 3.364685 0.931985
H -3.720053 1.745977 1.535662
H -4.650962 2.848095 -1.222761
H -5.686947 2.569952 0.210340
H -4.939934 1.187158 -0.649988
H 6.181745 -0.483159 -0.837862
H 5.043752 -1.822313 -1.294626
H 5.476414 -1.573664 0.430633
H -3.682810 -4.409836 -0.638746
H -2.566873 -5.525764 -1.538884
H -2.456231 -5.360499 0.266614


