%chk=000292937.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292937

0 1
O 4.698186 -0.202710 0.499262
O 4.032707 0.260558 -1.676378
O -1.565191 -2.579235 0.634526
O -1.114736 -2.302478 -1.610163
N 0.142114 0.342423 0.348576
C 1.179207 0.381853 -0.594403
C 0.659504 0.070423 1.648669
C -1.247581 0.598957 0.059418
C 2.373527 0.129900 0.117868
C 2.035849 -0.063734 1.512492
C 0.936658 0.631866 -2.053307
C -2.098389 -0.457783 -0.351708
C -0.233309 -0.041158 2.850310
C -1.762250 1.906687 0.198099
C 3.707134 0.081597 -0.470105
C -3.461505 -0.196307 -0.623492
C -3.124165 2.164904 -0.071299
C -3.973705 1.111930 -0.482143
C -1.538806 -1.838582 -0.548180
H 2.744850 -0.278806 2.308300
H 0.389264 1.578398 -2.223621
H 1.907549 0.683599 -2.568754
H 0.340883 -0.183031 -2.507777
H 0.378362 -0.271832 3.737740
H -0.784485 0.896686 3.055581
H -0.981970 -0.846970 2.731171
H -1.087034 2.708539 0.513885
H -4.116571 -1.012476 -0.945325
H -3.518611 3.180588 0.036215
H -5.030136 1.307451 -0.692804
H 5.577103 -0.218413 0.033300
H -1.165254 -3.478847 0.472649


%chk=000292937-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000292937

0 1
O 4.681552 -0.188614 0.568926
O 3.988949 0.070972 -1.631934
O -0.575086 -2.279767 -0.009961
O -2.344435 -2.658461 -1.456011
N 0.123872 0.344993 0.416794
C 1.149129 0.293502 -0.532167
C 0.649760 0.170140 1.727074
C -1.268473 0.555702 0.112940
C 2.350396 0.094236 0.185395
C 2.023933 0.015025 1.593137
C 0.904917 0.447782 -2.003749
C -2.107842 -0.454440 -0.444134
C -0.230941 0.120095 2.941164
C -1.797320 1.845942 0.351926
C 3.677518 0.001747 -0.409600
C -3.451413 -0.127726 -0.773296
C -3.141009 2.148518 0.045435
C -3.970391 1.157605 -0.528653
C -1.708961 -1.872326 -0.710939
H 2.737058 -0.143474 2.398504
H 0.316580 1.356626 -2.231582
H 1.876223 0.509144 -2.517960
H 0.351642 -0.414854 -2.423631
H 0.392140 -0.043153 3.835547
H -0.803359 1.054491 3.095667
H -0.962325 -0.708782 2.882304
H -1.131852 2.611905 0.762933
H -4.071510 -0.911820 -1.219376
H -3.531149 3.153365 0.238704
H -5.010427 1.385523 -0.783068
H 5.554995 -0.242059 0.095494
H -0.372975 -3.227841 -0.237282


