%chk=000253590.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253590

0 1
O 1.572044 3.239689 -0.366466
O -2.917642 1.635608 -1.142287
O 2.019124 -2.981740 -0.365471
O 2.874416 1.709065 -1.144139
O -3.591842 -0.258183 -0.365922
O 0.042037 -3.344464 -1.142194
N -0.740277 2.603225 0.587563
N 2.624890 -0.660330 0.586306
N -1.884239 -1.942641 0.588213
N 1.861655 2.049272 -0.548799
N -2.705788 0.588023 -0.547703
N 0.843350 -2.637288 -0.547509
C -0.433037 1.366373 0.140935
C 1.399798 -0.308121 0.140478
C -0.966862 -1.058088 0.141308
C 0.974631 1.053826 -0.044909
C -1.400084 0.317251 -0.044256
C 0.425150 -1.370984 -0.044277
C -2.085711 3.105796 0.915830
C 3.733071 0.253619 0.913674
C -1.646659 -3.359120 0.916371
H 0.006298 3.340264 0.583277
H 2.889811 -1.675435 0.582404
H -2.895844 -1.664743 0.583843
H -2.671005 3.353935 -0.001091
H -1.996649 4.026358 1.519507
H -2.670277 2.372555 1.499314
H 4.239089 0.637559 -0.003600
H 4.487027 -0.284141 1.515485
H 3.390886 1.125726 1.498585
H -1.568331 -3.990037 -0.000547
H -2.488688 -3.742551 1.519476
H -0.719642 -3.498577 1.500301


%chk=000253590-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253590

0 1
O 1.613942 3.368819 -0.058888
O -3.021681 1.603488 -1.118770
O 2.108641 -3.086185 -0.046864
O 2.897262 1.816767 -1.126467
O -3.727490 -0.281500 -0.050313
O 0.126905 -3.418864 -1.121997
N -0.817719 2.663744 0.422128
N 2.716549 -0.621996 0.422905
N -1.897866 -2.041917 0.422604
N 1.869670 2.108913 -0.389983
N -2.762201 0.567475 -0.381955
N 0.891632 -2.675669 -0.382796
C -0.465944 1.382773 0.131142
C 1.431217 -0.287886 0.130524
C -0.964896 -1.096114 0.132019
C 0.958185 1.068339 0.002880
C -1.404876 0.295205 0.007797
C 0.446550 -1.364686 0.006659
C -2.113106 3.191348 0.846480
C 3.821594 0.237793 0.842234
C -1.707927 -3.429104 0.842006
H 0.004374 3.309144 0.405039
H 2.863704 -1.656945 0.414298
H -2.867583 -1.651228 0.411891
H -2.771947 3.408458 -0.013929
H -1.928040 4.114813 1.419037
H -2.642630 2.468729 1.493333
H 4.336516 0.697869 -0.020751
H 4.530658 -0.382283 1.414489
H 3.461722 1.059025 1.487995
H -1.559142 -4.103753 -0.020809
H -2.603581 -3.734417 1.407034
H -0.821789 -3.528454 1.494729


