%chk=000258136.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258136

0 1
O 3.468019 0.722927 -0.455183
O -0.143043 -0.543094 2.385733
O 0.026252 -2.837711 -0.274847
O 1.775047 -1.071552 -2.278532
O 1.800182 2.261867 -0.415032
O 2.226659 -3.419985 -0.231969
N -2.097887 0.241717 1.531403
N -0.806659 0.616517 -0.959820
C 1.339315 -0.136869 -0.062467
C -0.130969 0.174898 0.062290
C -2.840209 0.740946 0.441599
C -2.171686 0.912706 -0.804125
C -0.722485 -0.083296 1.420215
C 1.524175 -1.226208 -1.122923
C 2.159336 1.116597 -0.349376
C -4.212438 1.061232 0.563561
C -2.894873 1.405361 -1.919696
C -4.891810 1.541129 -0.544929
C -4.237419 1.712690 -1.784753
C 1.355336 -2.637997 -0.499949
C 4.480445 1.748583 -0.730360
C 4.769011 2.538364 0.527075
C -0.381282 -4.048537 0.453435
C -0.043174 -3.889343 1.918125
H 1.716009 -0.531193 0.937470
H -2.558764 0.104562 2.434882
H -4.723725 0.933561 1.515517
H -2.368277 1.534769 -2.870063
H -5.951366 1.793324 -0.464877
H -4.800818 2.092833 -2.636903
H 5.324423 1.110880 -1.054521
H 4.118973 2.378740 -1.562052
H -1.466690 -4.048491 0.244773
H 0.112258 -4.917321 -0.015421
H 4.991760 1.880133 1.377171
H 3.908245 3.161333 0.814966
H 5.627098 3.207867 0.391319
H -0.588393 -4.607189 2.541298
H 1.030823 -4.038667 2.105461
H -0.284897 -2.877785 2.286208


%chk=000258136-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258136

0 1
O 3.512056 0.694257 0.122667
O 0.293155 1.458550 2.248784
O 0.298011 -2.649130 0.487782
O 2.095245 -1.050613 -2.110859
O 1.919055 2.167540 -0.744574
O 0.368595 -3.340773 -1.747607
N -1.837160 1.658033 1.296973
N -1.007794 0.080093 -0.866673
C 1.269584 -0.106933 0.012300
C -0.159973 0.382491 0.103259
C -2.767814 1.377173 0.289938
C -2.325920 0.558801 -0.803132
C -0.507166 1.198253 1.301235
C 1.396212 -1.181894 -1.088127
C 2.230451 1.063308 -0.251829
C -4.098413 1.863960 0.327269
C -3.235311 0.238195 -1.844657
C -4.980353 1.532831 -0.717377
C -4.553963 0.719859 -1.804546
C 0.624266 -2.506623 -0.859163
C 4.593088 1.705490 -0.112563
C 4.684202 2.676058 1.067529
C -0.402955 -3.918201 0.876379
C 0.612820 -5.030170 1.149212
H 1.554900 -0.560352 0.980674
H -2.110659 2.238433 2.097170
H -4.433151 2.492050 1.161169
H -2.869094 -0.383549 -2.666969
H -6.008737 1.908633 -0.691709
H -5.253847 0.474679 -2.609025
H 5.499522 1.089363 -0.220706
H 4.374216 2.232609 -1.057452
H -0.964110 -3.633885 1.780361
H -1.096336 -4.191702 0.061852
H 4.846048 2.132210 2.013887
H 3.762047 3.274044 1.154941
H 5.533624 3.367525 0.914043
H 0.085506 -5.929378 1.517912
H 1.155314 -5.304049 0.229101
H 1.341341 -4.718890 1.917236


