%chk=000240657.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240657

0 1
O 2.725257 1.906128 -0.903886
O 3.370884 -2.142589 -0.780266
O 0.121936 -0.868052 1.361802
O 5.102330 -0.790197 0.001900
N -0.682607 -1.218183 -0.789428
N -5.322657 -0.280962 -1.066827
C 1.300381 1.498366 -0.737581
C 3.165609 1.399428 0.437801
C 1.468822 -0.056546 -0.535918
C 2.746620 -0.101864 0.369933
C 0.887073 2.212640 0.577976
C 2.220501 2.154629 1.408074
C 0.264599 -0.751634 0.101529
C 3.864412 -0.990004 -0.141798
C -1.915435 -1.900614 -0.342754
C -3.117845 -0.972178 -0.224838
C -3.181300 0.026527 0.781795
C -4.216146 -1.081432 -1.113137
C -4.316529 0.861630 0.847999
C -5.357214 0.676305 -0.093843
H 0.740159 1.784319 -1.638716
H 4.243659 1.568618 0.549723
H 1.687411 -0.502521 -1.520890
H 2.453706 -0.482449 1.369924
H 0.051183 1.711429 1.092348
H 0.595186 3.252973 0.360046
H 2.610703 3.165177 1.611633
H 2.095494 1.624420 2.367280
H -0.527859 -1.090561 -1.791094
H 4.138585 -2.715654 -1.051223
H -1.683292 -2.346843 0.640771
H -2.136905 -2.718659 -1.052146
H -2.356336 0.127975 1.496018
H -4.219619 -1.847340 -1.900452
H -4.402670 1.638405 1.614438
H -6.253496 1.306820 -0.075392


%chk=000240657-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240657

0 1
O 2.724837 2.024782 -0.721322
O 3.185010 -1.980610 -1.284280
O 0.309707 -0.896697 1.529777
O 5.065248 -0.880944 -0.489972
N -0.743470 -1.054221 -0.538719
N -5.539897 -0.911007 -1.022265
C 1.321574 1.639282 -0.393157
C 3.333590 1.325805 0.457183
C 1.441545 0.067607 -0.431111
C 2.832897 -0.140651 0.258805
C 1.143678 2.174514 1.053984
C 2.582738 1.968666 1.651976
C 0.308972 -0.675848 0.276388
C 3.820304 -0.985765 -0.522055
C -1.931558 -1.754323 -0.020100
C -3.220581 -0.966164 -0.206152
C -3.350846 0.365159 0.265344
C -4.345488 -1.549217 -0.840431
C -4.575623 1.042174 0.089274
C -5.639822 0.368584 -0.557557
H 0.649314 2.062488 -1.152711
H 4.423634 1.444754 0.424393
H 1.496670 -0.237368 -1.489604
H 2.674955 -0.638946 1.236748
H 0.377386 1.623606 1.622908
H 0.870163 3.242063 1.025750
H 3.047707 2.931522 1.919416
H 2.577270 1.318754 2.542974
H -0.683833 -0.872788 -1.542531
H 3.879289 -2.535405 -1.733514
H -1.727166 -1.923147 1.053819
H -2.024122 -2.745529 -0.504132
H -2.506225 0.854555 0.764034
H -4.294901 -2.577051 -1.223471
H -4.712008 2.068137 0.445534
H -6.606349 0.860737 -0.714420


