%chk=000276886.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276886

0 1
O 0.864588 -3.229607 -0.095035
O -1.278182 -2.593493 -0.090963
O -4.992378 1.755275 0.013541
O 4.260850 1.887667 0.016433
O 4.535456 -0.257960 -0.025263
O -4.552151 -0.451430 -0.033610
N -1.776005 0.064968 -0.038995
N 3.835301 0.742266 -0.007686
C -0.419238 0.240287 -0.031237
C 0.448792 -0.907009 -0.051142
C 0.171500 1.546407 -0.003996
C 1.838189 -0.726294 -0.043103
C 2.384706 0.559034 -0.016056
C 1.537482 1.698367 0.003428
C -2.719691 1.199258 -0.018814
C -0.105331 -2.258368 -0.079761
C -4.142439 0.679580 -0.015249
H -0.461789 2.430270 0.010853
H -2.196737 -0.895500 -0.059130
H 2.504240 -1.606387 -0.058294
H 1.998433 2.695487 0.024350
H -2.573096 1.865153 -0.910022
H -2.560739 1.844476 0.885351
H 0.471902 -4.148814 -0.114662
H -5.955262 1.486569 0.016961


%chk=000276886-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276886

0 1
O 0.848408 -3.276870 -0.095477
O -1.348489 -2.548599 -0.084857
O -5.048120 1.752465 0.003290
O 4.323978 1.950534 0.011980
O 4.602652 -0.317379 -0.031288
O -4.491435 -0.509884 -0.042553
N -1.789618 0.094482 -0.033546
N 3.857678 0.741116 -0.012227
C -0.426326 0.246801 -0.029054
C 0.455140 -0.907564 -0.050409
C 0.175334 1.551847 -0.002926
C 1.855520 -0.727449 -0.044658
C 2.399545 0.567065 -0.018356
C 1.560947 1.712144 0.002436
C -2.721080 1.212614 -0.009997
C -0.112660 -2.266481 -0.077548
C -4.149517 0.688524 -0.018818
H -0.459641 2.441303 0.012942
H -2.165142 -0.873218 -0.053237
H 2.517427 -1.596299 -0.060533
H 2.020057 2.704284 0.022329
H -2.597915 1.883096 -0.885804
H -2.595520 1.846954 0.891959
H 0.389851 -4.159179 -0.113304
H -5.982675 1.409896 -0.002447


