%chk=000186723.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186723

0 1
I -6.273477 0.007912 0.001354
S 0.389140 -2.628915 -0.735604
S 0.395219 2.630069 0.735677
N 2.186189 -0.651035 -0.296823
N 2.187754 0.648152 0.296586
N 0.048813 0.000836 0.000390
C 3.393568 -1.494588 -0.066940
C 3.396847 1.489061 0.065990
C 4.647347 -0.667382 -0.385247
C 4.649004 0.659138 0.383589
C 0.862785 -1.122834 -0.318909
C 0.865377 1.122881 0.318999
C -1.398604 0.002474 0.000615
C -2.083625 0.459793 1.137868
C -2.084968 -0.453437 -1.136308
C -3.481593 0.463057 1.129064
C -3.482930 -0.453533 -1.127103
C -4.161060 0.005560 0.001059
H 3.309836 -2.381351 -0.742743
H 3.416020 -1.873305 0.980827
H 3.315421 2.376005 0.741834
H 3.419529 1.867728 -0.981788
H 4.707046 -0.474413 -1.476538
H 5.549010 -1.259993 -0.132245
H 4.708903 0.466048 1.474849
H 5.551805 1.249790 0.130069
H -1.541351 0.816408 2.015858
H -1.543769 -0.811557 -2.014342
H -4.024974 0.822956 2.005851
H -4.027361 -0.812324 -2.003691


%chk=000186723-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186723

0 1
I -6.324677 0.007691 0.002720
S 0.402139 -2.735055 -0.651621
S 0.408063 2.736327 0.650632
N 2.178878 -0.671336 -0.243702
N 2.180349 0.668828 0.242080
N 0.074897 0.001030 -0.000690
C 3.392304 -1.498886 -0.120691
C 3.395841 1.493492 0.119855
C 4.642295 -0.650073 -0.425933
C 4.643723 0.641639 0.425402
C 0.874361 -1.133924 -0.319082
C 0.876878 1.134521 0.316518
C -1.364300 0.002409 0.000144
C -2.064159 0.497003 1.123008
C -2.066369 -0.490769 -1.121965
C -3.475515 0.502690 1.124973
C -3.477734 -0.493538 -1.122436
C -4.171082 0.005300 0.001634
H 3.265745 -2.340372 -0.821442
H 3.443950 -1.918228 0.905195
H 3.270998 2.335126 0.820735
H 3.448897 1.912962 -0.905908
H 4.665550 -0.391685 -1.501982
H 5.538805 -1.258146 -0.211746
H 4.666051 0.383173 1.501452
H 5.541739 1.247592 0.211501
H -1.516106 0.884423 1.985445
H -1.520033 -0.879288 -1.984994
H -4.015829 0.888201 1.993428
H -4.019758 -0.877906 -1.990332


