%chk=000203505.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203505

0 1
O -3.534464 1.663465 -0.315450
O 1.837057 1.774697 1.298885
N -1.075133 0.169141 -0.261285
N 0.123107 2.164047 -0.829511
N 1.308376 1.402769 -0.900489
N 5.309848 -0.728621 0.297789
C -2.268355 2.370285 -0.197341
C -1.062313 1.469258 -0.380664
C -3.530072 0.311440 -0.030910
C -2.332070 -0.444180 0.003611
C -4.782989 -0.279112 0.168137
C -2.405751 -1.819746 0.270770
C -4.828148 -1.650996 0.423699
C -3.652719 -2.412724 0.480936
C 3.004834 -0.002935 0.168886
C 2.010499 1.094077 0.308770
C 2.589405 -1.308091 -0.130087
C 4.374346 0.248869 0.387250
C 3.548909 -2.318496 -0.216225
C 4.898163 -1.989870 0.001070
H -2.271296 2.840175 0.806890
H -2.365148 3.141654 -0.989356
H -5.685158 0.326647 0.121771
H -1.490198 -2.409965 0.308833
H 0.300916 3.034606 -0.287681
H -5.792655 -2.133932 0.584294
H -3.712658 -3.479644 0.689163
H 1.260142 0.692547 -1.646595
H 1.528781 -1.530206 -0.281129
H 4.735906 1.254914 0.641155
H 3.259983 -3.342578 -0.443663
H 5.687954 -2.749893 -0.058126


%chk=000203505-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000203505

0 1
O -3.512173 1.757700 -0.424737
O 2.615837 2.373495 -0.029848
N -1.446636 -0.131698 0.170982
N 0.078691 1.614693 0.154660
N 1.092824 0.658646 0.068735
N 5.846993 -0.315139 -0.578829
C -2.329309 2.203394 0.339119
C -1.220310 1.173639 0.202734
C -3.839959 0.392623 -0.199510
C -2.807473 -0.538814 0.127639
C -5.172511 -0.015360 -0.377091
C -3.161301 -1.896354 0.315196
C -5.503946 -1.377887 -0.190028
C -4.501494 -2.313547 0.165342
C 3.469875 0.081175 -0.109210
C 2.394720 1.112872 -0.019783
C 3.278796 -1.301393 0.149257
C 4.775154 0.518900 -0.463492
C 4.378290 -2.176449 0.032120
C 5.636870 -1.643975 -0.334213
H -2.605670 2.321579 1.408302
H -2.056802 3.185710 -0.078979
H -5.928056 0.727533 -0.650694
H -2.367739 -2.609087 0.562195
H 0.422479 2.580133 0.133995
H -6.541561 -1.703956 -0.317452
H -4.763581 -3.366302 0.314262
H 0.718622 -0.298253 0.025206
H 2.305250 -1.699347 0.457846
H 4.948912 1.582472 -0.655363
H 4.269254 -3.247434 0.227443
H 6.515054 -2.291969 -0.432405


