%chk=000250322.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250322

0 1
O 5.041753 0.434054 1.074747
O -4.788647 -0.156629 1.297100
O 7.173550 -0.246617 1.369884
O -6.752767 -0.414372 2.382379
N 2.883618 0.732414 0.397199
N -3.161345 0.085840 -0.454151
C 0.455196 0.438678 0.357054
C -0.751055 0.339257 -0.385077
C 1.694941 0.567445 -0.372982
C -1.991455 0.189453 0.346216
C 0.417941 0.412532 1.786063
C -0.708378 0.394495 -1.813620
C 1.707180 0.620263 -1.754891
C -1.992888 0.156808 1.730879
C -0.775722 0.275070 2.450091
C 0.485816 0.539165 -2.474493
C 3.967599 0.079754 0.209113
C -4.367154 -0.060449 -0.071717
C 5.731927 -1.301822 -0.377163
C -6.666680 -0.311359 -0.112772
C 4.455892 -1.013805 -0.679955
C -5.591176 -0.164907 -0.906899
C 6.163808 -0.389186 0.754620
C -6.205309 -0.313954 1.329299
C 6.667246 -2.284916 -0.938908
C -8.092677 -0.453901 -0.438273
H 1.356118 0.519488 2.338617
H -1.648295 0.324643 -2.366758
H 2.636327 0.748550 -2.306438
H -2.927331 0.044152 2.292204
H -0.809883 0.258226 3.539965
H 0.517801 0.593543 -3.562523
H 3.811684 -1.459836 -1.422329
H -5.533302 -0.118794 -1.985036
H 6.218917 -2.886300 -1.744097
H 7.028467 -2.987562 -0.166615
H 7.566802 -1.796681 -1.354560
H -8.509550 -1.391657 -0.030241
H -8.282439 -0.455016 -1.522103
H -8.690431 0.365631 -0.001128


%chk=000250322-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250322

0 1
O 5.164139 0.464000 1.056767
O -4.908442 -0.102516 1.356360
O 7.426835 -0.189137 1.091391
O -7.062904 -0.318795 2.292735
N 2.892747 0.622492 0.538857
N -3.172503 0.064223 -0.363110
C 0.462463 0.400572 0.477438
C -0.763519 0.283327 -0.277589
C 1.726649 0.464512 -0.232617
C -2.026130 0.183435 0.440061
C 0.415764 0.439791 1.904930
C -0.711871 0.276447 -1.706910
C 1.734360 0.474281 -1.644235
C -2.027730 0.216694 1.856159
C -0.811204 0.353067 2.575005
C 0.515019 0.387229 -2.370973
C 4.032458 0.067047 0.273253
C -4.412850 -0.056577 -0.008045
C 5.804913 -1.239486 -0.475251
C -6.723634 -0.288239 -0.172276
C 4.468843 -0.991078 -0.659633
C -5.565557 -0.173983 -0.901845
C 6.295686 -0.321305 0.601812
C -6.358971 -0.249374 1.274301
C 6.717076 -2.226096 -1.135362
C -8.147791 -0.430701 -0.614400
H 1.355755 0.553647 2.452885
H -1.654084 0.198568 -2.254424
H 2.680057 0.610255 -2.180245
H -2.976027 0.143460 2.393512
H -0.839676 0.394273 3.668803
H 0.543697 0.413997 -3.465613
H 3.791847 -1.500521 -1.344738
H -5.457912 -0.165301 -1.985851
H 6.189643 -2.827701 -1.892763
H 7.161600 -2.907227 -0.386222
H 7.564390 -1.706561 -1.620347
H -8.593567 -1.356317 -0.205426
H -8.231618 -0.453974 -1.712815
H -8.761854 0.405272 -0.230880


