%chk=000235968.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235968

0 1
O -4.065828 1.518345 -0.409523
O -4.767036 -0.241286 0.783480
N -2.525400 -1.814552 -0.108157
C 2.439138 0.351391 -0.336596
C 3.591368 1.234643 0.196448
C 2.871994 -1.100393 -0.030150
C 4.864018 0.374223 0.103983
C 4.411252 -1.096408 -0.000720
C 1.088464 0.729724 0.289512
C -0.076442 -0.018638 -0.369631
C -1.420563 0.397250 0.241052
C -2.591697 -0.369513 -0.405323
C -3.912339 0.247261 0.083549
H 2.374499 0.479589 -1.442775
H 3.406714 1.533442 1.242644
H 3.685133 2.166092 -0.382056
H 2.481308 -1.802064 -0.783204
H 2.468630 -1.432618 0.941882
H 5.511747 0.530692 0.981625
H 5.463066 0.657844 -0.777958
H 4.821519 -1.564192 -0.911431
H 4.789065 -1.689279 0.848163
H 0.935324 1.822495 0.193693
H 1.104652 0.523922 1.377122
H 0.061215 -1.114508 -0.259749
H -0.081265 0.169963 -1.460650
H -1.580589 1.486979 0.097968
H -1.406864 0.229893 1.335791
H -2.550589 -0.242915 -1.524838
H -3.357405 -2.300786 -0.435058
H -2.443243 -1.988776 0.890532
H -4.914945 1.947680 -0.118026


%chk=000235968-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000235968

0 1
O -4.270874 1.364421 -0.802162
O -4.694193 -0.065983 0.980106
N -2.527682 -1.780612 0.062525
C 2.476278 0.379485 -0.230008
C 3.656576 1.167895 0.396823
C 2.894135 -1.095388 0.022048
C 4.923874 0.360515 -0.000378
C 4.440472 -1.122491 -0.176512
C 1.091767 0.767877 0.332074
C -0.083284 0.017844 -0.336095
C -1.455737 0.467012 0.206222
C -2.626246 -0.382949 -0.374878
C -3.958746 0.275649 0.027291
H 2.477343 0.562699 -1.327244
H 3.535808 1.179022 1.499425
H 3.696672 2.220027 0.059211
H 2.372494 -1.810914 -0.638262
H 2.633965 -1.364666 1.066213
H 5.724515 0.451054 0.755749
H 5.336242 0.743831 -0.952533
H 4.697318 -1.494077 -1.185693
H 4.926333 -1.802043 0.546817
H 0.943730 1.862114 0.211453
H 1.080452 0.569661 1.425467
H 0.014170 -1.072315 -0.181242
H -0.050280 0.190355 -1.432744
H -1.630999 1.532459 -0.038444
H -1.470632 0.378688 1.312449
H -2.557236 -0.346205 -1.477692
H -3.110602 -2.427919 -0.478425
H -2.694830 -1.889440 1.070037
H -5.115901 1.789895 -0.489998


