%chk=000294902.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294902

0 1
O -2.877537 0.590094 0.114468
O 0.314024 -2.120974 -0.243510
O 3.745112 1.273112 -1.250867
O -2.531984 -1.643893 -0.285875
O 5.537476 1.587981 0.044937
N -0.767365 -0.104134 0.086767
N 4.160941 -0.238965 1.838190
C -4.372475 0.511565 0.029605
C 2.889209 -1.038440 -0.151211
C 4.218766 -0.462746 0.365274
C 1.677568 -0.170597 0.203451
C -4.742942 0.043522 -1.368471
C -4.860129 -0.421520 1.126188
C -4.722523 1.974205 0.285917
C 0.393501 -0.939639 -0.017600
C -2.113086 -0.537854 -0.059352
C 4.592136 0.892053 -0.237952
H 2.746203 -2.065848 0.251182
H 2.947293 -1.156493 -1.255183
H 5.045598 -1.167260 0.055845
H 1.709043 0.764409 -0.400274
H 1.742096 0.164298 1.265239
H -5.825224 0.076918 -1.531654
H -4.418764 -0.996313 -1.542574
H -4.268529 0.657578 -2.142839
H -4.535792 -1.459760 0.943294
H -5.953155 -0.430564 1.191828
H -4.468185 -0.135027 2.109103
H -5.806210 2.130686 0.265719
H -4.349735 2.309742 1.262187
H -4.270896 2.631911 -0.467727
H -0.647667 0.898442 0.283153
H 3.881399 -1.088746 2.320199
H 5.069868 0.047827 2.199422
H 4.014466 2.141731 -1.660881


%chk=000294902-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294902

0 1
O -2.871948 0.594406 0.082794
O 0.345447 -2.254542 -0.069185
O 4.380720 1.270359 -1.432294
O -2.552994 -1.749481 -0.091104
O 4.890351 1.892934 0.743728
N -0.765722 -0.184064 0.092711
N 4.259706 -0.596998 1.726056
C -4.397467 0.532570 0.025127
C 2.899958 -0.951165 -0.342711
C 4.242531 -0.452404 0.269588
C 1.685912 -0.217076 0.251555
C -4.829479 -0.075195 -1.324189
C -4.918289 -0.270077 1.233729
C -4.777587 2.019529 0.124828
C 0.387150 -1.007655 0.064050
C -2.117799 -0.587812 0.015192
C 4.529894 1.009936 -0.066732
H 2.795789 -2.028966 -0.119885
H 2.934424 -0.842781 -1.440744
H 5.053345 -1.024948 -0.245205
H 1.589216 0.803044 -0.169425
H 1.872669 -0.110224 1.342484
H -5.929471 -0.015676 -1.415968
H -4.526755 -1.131241 -1.400205
H -4.383878 0.488742 -2.162878
H -4.618439 -1.327693 1.168408
H -6.022094 -0.217675 1.258856
H -4.532220 0.156116 2.176682
H -5.876333 2.127654 0.092590
H -4.409806 2.453199 1.070727
H -4.343635 2.589499 -0.714756
H -0.630310 0.825326 0.191971
H 4.390075 -1.547354 2.072961
H 4.774764 0.128736 2.230451
H 4.624776 2.218279 -1.613211


