%chk=000283863.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000283863

0 1
O -2.970931 -0.083942 -0.661681
O -5.423195 -0.308637 -1.360366
N 2.584783 -0.104211 -0.092381
N 4.793368 1.070073 -0.110336
N 4.582318 -1.247887 0.651645
N 2.493188 -2.273449 0.990579
N 6.706713 -0.209520 0.419252
N -6.339078 0.370153 0.606886
C 3.367089 1.193168 -0.426693
C 3.208062 1.440183 -1.934367
C 2.782808 2.344479 0.405234
C 1.142320 -0.090415 -0.181712
C 3.249630 -1.189656 0.495855
C 5.312405 -0.071644 0.309950
C 0.362074 0.208886 0.943805
C 0.533852 -0.384213 -1.422027
C -1.033011 0.227832 0.846280
C -0.847696 -0.367210 -1.532752
C -1.621807 -0.057607 -0.390888
C -3.875922 0.229239 0.429218
C -5.253469 0.068141 -0.217383
C -7.712899 0.262555 0.066040
C -6.201631 0.859752 1.992215
H 3.850904 2.278958 -2.240039
H 3.528832 0.573068 -2.523321
H 2.179562 1.687290 -2.210092
H 3.373366 3.257186 0.237388
H 1.744437 2.563324 0.141232
H 2.831901 2.135312 1.479391
H 0.843486 0.422502 1.899870
H 1.153979 -0.621105 -2.288769
H -1.626409 0.461439 1.723153
H -1.354027 -0.584915 -2.473836
H 3.034421 -3.099629 1.236317
H 1.620185 -2.487881 0.525997
H 7.239851 0.649310 0.459456
H 7.040970 -0.944960 1.027552
H -3.690076 1.264777 0.765755
H -3.723111 -0.491843 1.252227
H -8.308264 -0.454997 0.653088
H -8.216336 1.242511 0.066675
H -7.680052 -0.101448 -0.982390
H -5.688386 1.836587 2.024944
H -7.191111 0.996340 2.462362
H -5.645594 0.138804 2.616065


%chk=000283863-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000283863

0 1
O -3.055539 -0.093911 -0.740235
O -5.656490 -0.339657 -1.323988
N 2.582765 -0.039367 -0.055446
N 4.688846 1.208440 0.354043
N 4.595835 -1.243448 0.490986
N 2.587997 -2.399226 0.235047
N 6.467840 -0.055539 1.213236
N -6.391575 0.369318 0.773229
C 3.424334 1.213591 -0.397183
C 3.721743 1.200788 -1.923770
C 2.637148 2.478626 -0.006000
C 1.149009 -0.048795 -0.205809
C 3.284950 -1.207162 0.215436
C 5.204531 0.021101 0.650355
C 0.315637 0.200680 0.910510
C 0.544895 -0.313180 -1.467261
C -1.091165 0.199941 0.785140
C -0.854222 -0.319195 -1.605765
C -1.677384 -0.060370 -0.480467
C -3.948800 0.166942 0.378001
C -5.397006 0.041957 -0.148603
C -7.799915 0.324779 0.340983
C -6.148750 0.862720 2.137564
H 4.383417 2.050238 -2.166833
H 4.242106 0.267339 -2.203865
H 2.794172 1.296235 -2.517901
H 3.276431 3.350176 -0.222554
H 1.693738 2.573579 -0.570802
H 2.421011 2.476113 1.075723
H 0.782087 0.398818 1.881101
H 1.181440 -0.515299 -2.335135
H -1.705195 0.401638 1.667972
H -1.335248 -0.520778 -2.567408
H 3.110069 -3.229289 0.502867
H 1.613246 -2.458058 -0.046070
H 6.997710 0.798331 1.358924
H 6.814891 -0.960461 1.515089
H -3.767608 1.184500 0.783368
H -3.775883 -0.571493 1.190727
H -8.378454 -0.375804 0.972511
H -8.261861 1.328813 0.407846
H -7.828321 -0.017747 -0.704397
H -6.240118 1.966363 2.198190
H -6.892853 0.420280 2.824985
H -5.151965 0.574173 2.505057


