%chk=000256853.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256853

0 1
O -0.828121 -0.613387 -2.401759
O -0.891818 1.895911 0.861810
N 0.004673 0.178909 -0.389426
N 0.197896 -2.160456 -1.071785
N -1.749040 1.598848 -1.276990
C 1.270953 0.224919 0.328965
C -0.234889 -0.863986 -1.354560
C 0.645823 -2.638415 0.217779
C -0.911152 1.302831 -0.198715
C 0.114397 -3.168680 -2.163352
C 1.291790 0.426175 1.717599
C 2.463999 0.081778 -0.401275
C 1.893310 -3.275196 0.323156
C -0.192158 -2.498785 1.337322
C -2.781024 2.594491 -1.251970
C 2.522765 0.472296 2.376368
C 3.682844 0.122618 0.278352
C 2.298762 -3.770944 1.564597
C 0.234356 -2.996974 2.570101
C 3.715776 0.315857 1.663643
C 1.474388 -3.634209 2.686160
C -3.589072 2.690056 -2.405714
C -2.995601 3.449418 -0.158909
C -4.603913 3.644918 -2.449500
C -4.019319 4.396815 -0.226044
C -4.824610 4.500164 -1.363831
H -0.311904 -4.110994 -1.781262
H 1.114270 -3.366982 -2.582929
H -0.538493 -2.802577 -2.981188
H 0.358172 0.567604 2.267492
H 2.442724 -0.053068 -1.480847
H 2.541803 -3.369974 -0.545191
H -1.156750 -2.000397 1.248203
H -1.662403 1.046062 -2.158832
H 2.548693 0.632634 3.453918
H 4.613015 0.010755 -0.277313
H 3.266962 -4.262387 1.657926
H -0.406229 -2.888251 3.445457
H 4.669978 0.350225 2.185463
H 1.798953 -4.020957 3.650575
H -3.427507 2.029238 -3.254761
H -2.369625 3.380875 0.736304
H -5.229718 3.723304 -3.338210
H -4.187149 5.061752 0.621390
H -5.618405 5.241464 -1.406416


%chk=000256853-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256853

0 1
O -0.847431 -0.548635 -2.426145
O -0.578667 2.115629 0.839702
N 0.114592 0.230325 -0.402322
N 0.355968 -2.049246 -1.114299
N -1.738079 1.557297 -1.132783
C 1.409830 0.251272 0.267417
C -0.163750 -0.782333 -1.367107
C 0.594305 -2.567434 0.216437
C -0.762798 1.385987 -0.172927
C 0.371673 -3.026709 -2.228464
C 1.512194 0.338146 1.673282
C 2.576166 0.228471 -0.534639
C 1.812077 -3.221535 0.517147
C -0.430466 -2.492584 1.192061
C -2.785119 2.519652 -1.133208
C 2.788411 0.391279 2.274226
C 3.849036 0.265037 0.074119
C 2.006358 -3.790701 1.794014
C -0.224562 -3.052086 2.471171
C 3.958686 0.348833 1.481927
C 0.992030 -3.705972 2.775966
C -3.702587 2.456391 -2.218781
C -2.950366 3.515253 -0.132699
C -4.769199 3.372720 -2.303709
C -4.026995 4.423613 -0.231767
C -4.940715 4.363995 -1.308632
H -0.377536 -3.821439 -2.059849
H 1.369909 -3.490047 -2.312416
H 0.123502 -2.500296 -3.161456
H 0.605494 0.370827 2.280492
H 2.482707 0.195376 -1.626049
H 2.609770 -3.259811 -0.232212
H -1.378998 -2.002936 0.945971
H -1.663754 0.914318 -1.946831
H 2.866635 0.463219 3.364420
H 4.749802 0.249113 -0.549514
H 2.953942 -4.289146 2.025430
H -1.018239 -2.988569 3.223660
H 4.946037 0.388726 1.955272
H 1.147629 -4.145228 3.767241
H -3.575520 1.687048 -2.990438
H -2.240689 3.568686 0.694645
H -5.466879 3.311315 -3.146468
H -4.147018 5.188960 0.543658
H -5.769984 5.076515 -1.373742


