%chk=000261225.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261225

0 1
O -4.658949 0.469226 -0.272623
O -4.523472 0.399813 1.975532
N 3.511396 -0.159918 -1.124855
N 2.251916 0.193411 -0.906228
N 1.659322 -0.256447 0.137824
C 5.204274 -0.111683 0.823336
C 4.377504 -0.937480 -0.194612
C 4.354614 0.934258 1.544489
C 6.437087 0.529037 0.176959
C 4.186422 0.644958 -2.176085
C 0.246429 -0.039628 0.232076
C -2.505357 0.228302 0.643934
C -0.269617 -0.030635 1.547552
C -0.620193 0.085107 -0.872362
C -1.638439 0.102801 1.746230
C -1.990627 0.217822 -0.661691
C -3.950924 0.368086 0.906346
C -6.116797 0.612676 -0.150082
C -6.592420 0.712709 -1.583558
H 5.566706 -0.848832 1.589582
H 5.056868 -1.559992 -0.817238
H 3.723870 -1.648128 0.369791
H 4.904885 1.395986 2.370800
H 3.441717 0.486777 1.963247
H 4.031889 1.739947 0.876132
H 6.157356 1.263199 -0.592415
H 7.085176 -0.217265 -0.293199
H 7.039182 1.060579 0.923568
H 4.953770 1.315374 -1.737779
H 3.465758 1.265272 -2.739390
H 4.675841 -0.039948 -2.889732
H 0.409483 -0.133185 2.393790
H -0.218902 0.077502 -1.884597
H -2.055238 0.111915 2.758000
H -2.674360 0.314973 -1.509945
H -6.496298 -0.276814 0.381676
H -6.315651 1.519122 0.447301
H -7.682527 0.817531 -1.633191
H -6.144153 1.575600 -2.094844
H -6.309941 -0.177928 -2.161639


%chk=000261225-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261225

0 1
O -4.604258 0.587591 -0.325049
O -4.539872 -0.227814 1.859380
N 3.638925 -0.273196 -1.033930
N 2.282663 -0.154373 -0.967024
N 1.762074 -0.428355 0.213653
C 5.220178 0.283924 0.919102
C 4.479114 -0.794710 0.074297
C 4.239275 1.234361 1.642687
C 6.261306 1.083497 0.098924
C 4.184468 -0.170394 -2.394555
C 0.344157 -0.267953 0.254229
C -2.469216 -0.022878 0.581530
C -0.275080 -0.637644 1.480803
C -0.463671 0.233133 -0.810731
C -1.665057 -0.518293 1.642206
C -1.852004 0.351692 -0.644543
C -3.934275 0.085415 0.801081
C -6.083048 0.723663 -0.187989
C -6.596538 1.295199 -1.505969
H 5.772134 -0.297085 1.689497
H 5.221123 -1.482515 -0.376876
H 3.804663 -1.371175 0.733488
H 4.792023 1.941327 2.289102
H 3.518982 0.675620 2.264181
H 3.656346 1.824307 0.911522
H 5.764983 1.756394 -0.625219
H 6.949518 0.417480 -0.456008
H 6.872104 1.716980 0.767929
H 5.109560 0.428579 -2.396903
H 3.429200 0.314183 -3.031433
H 4.414020 -1.172566 -2.809865
H 0.359493 -1.016632 2.288226
H 0.015179 0.520869 -1.750865
H -2.152976 -0.801288 2.580560
H -2.478708 0.734619 -1.455068
H -6.506218 -0.272758 0.035368
H -6.295671 1.384106 0.672408
H -7.694527 1.414670 -1.460011
H -6.147728 2.282792 -1.708563
H -6.355041 0.623323 -2.347469


