%chk=000207346.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207346

0 1
O -2.257177 -2.432277 -1.139509
O -3.365690 -2.209283 0.788604
N 0.107912 0.990717 -0.010305
N 0.416179 -1.307324 0.035836
C 1.516234 0.767206 -0.000925
C -0.510341 -0.345059 0.001705
C 1.674815 -0.660398 0.030468
C -0.658803 2.156768 -0.006412
C -1.943140 -0.402666 0.004592
C -2.688582 0.761114 0.039391
C -2.029914 2.032993 0.023819
C 2.965932 -1.238141 0.049707
C 2.622973 1.625576 -0.014468
C 0.028391 3.475766 -0.032371
C 4.051960 -0.364656 0.035257
C 3.881515 1.035974 0.003562
C -4.176174 0.727218 0.070437
C 3.133982 -2.715466 0.098380
C -2.588876 -1.729885 -0.007762
H -2.649028 2.928947 0.033797
H 2.514132 2.703360 -0.039323
H 0.675134 3.617152 0.850356
H -0.683453 4.315894 -0.039860
H 0.661653 3.589819 -0.928602
H 5.064241 -0.767105 0.049164
H 4.769310 1.668686 -0.007061
H -4.621269 1.656027 0.451482
H -4.557400 -0.091419 0.711047
H -4.591368 0.557826 -0.936169
H 4.051324 -3.056157 -0.395934
H 3.160435 -3.069969 1.140815
H 2.284211 -3.234177 -0.379316
H -2.631019 -3.355262 -1.134002


%chk=000207346-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207346

0 1
O -1.988955 -2.645090 -0.939338
O -3.634323 -2.057497 0.577770
N 0.114861 1.001792 -0.021674
N 0.434182 -1.299360 -0.022655
C 1.516249 0.790613 -0.012296
C -0.494400 -0.324172 -0.040603
C 1.671222 -0.639736 -0.008983
C -0.651206 2.163952 0.011884
C -1.930078 -0.414918 -0.031540
C -2.706248 0.759657 0.041267
C -2.036016 2.029357 0.046895
C 2.961093 -1.242928 0.006207
C 2.636953 1.655426 0.000425
C 0.031828 3.506510 0.011452
C 4.065175 -0.367258 0.018501
C 3.907838 1.049798 0.015460
C -4.220942 0.746409 0.095364
C 3.096987 -2.748761 0.006698
C -2.596933 -1.746509 -0.063268
H -2.635619 2.942958 0.074963
H 2.555195 2.743408 -0.003118
H 0.681393 3.632424 0.897591
H -0.723024 4.307733 0.025338
H 0.660476 3.642119 -0.888151
H 5.076798 -0.789643 0.029608
H 4.799967 1.685654 0.023942
H -4.624272 1.763383 -0.044433
H -4.572312 0.352878 1.065333
H -4.658120 0.085397 -0.673218
H 4.156041 -3.057518 0.028114
H 2.579991 -3.189363 0.878574
H 2.616722 -3.185710 -0.887846
H -2.462422 -3.519206 -0.871863


