%chk=000245220.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245220

0 1
I 4.498414 1.671021 -0.007748
S -2.952025 0.127946 -1.471513
N -0.646206 0.122472 -0.136246
N 0.893378 1.834214 -0.193897
N 0.952032 -1.795803 0.102103
N 3.275488 -1.046560 0.150500
C -1.930718 -0.582083 -0.116883
C -2.718711 -0.359645 1.178403
C -4.212903 -0.242119 0.846758
C -4.383042 0.569344 -0.430764
C 0.615533 -0.474803 -0.023102
C -0.409375 1.531667 -0.234400
C 1.578840 0.616271 -0.063456
C 2.934030 0.242118 0.030652
C 2.284204 -2.016280 0.181469
H -1.752288 -1.673669 -0.319275
H -2.372317 0.552823 1.706493
H -2.538357 -1.191779 1.888167
H -4.657112 -1.252165 0.726162
H -4.759776 0.225732 1.689079
H -5.314043 0.321994 -0.971860
H -4.388964 1.657632 -0.242944
H -1.223240 2.241267 -0.345816
H 2.630659 -3.058492 0.281120


%chk=000245220-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245220

0 1
I 4.594433 1.552134 0.042700
S -3.012456 0.174784 -1.561278
N -0.595885 0.218790 -0.120256
N 1.016381 1.863076 -0.151667
N 0.867700 -1.769607 0.069257
N 3.235913 -1.165291 0.138812
C -1.908541 -0.438978 -0.112452
C -2.715411 -0.181202 1.183513
C -4.208198 -0.378967 0.853540
C -4.502577 0.457149 -0.408368
C 0.634020 -0.437922 -0.027894
C -0.299795 1.590879 -0.195583
C 1.628437 0.604288 -0.044585
C 2.963929 0.150191 0.046364
C 2.196489 -2.066025 0.145915
H -1.717244 -1.513142 -0.266204
H -2.539236 0.858483 1.518979
H -2.371215 -0.857737 1.985959
H -4.414610 -1.446112 0.649881
H -4.851954 -0.063534 1.694888
H -5.403902 0.121135 -0.943101
H -4.579610 1.533668 -0.183786
H -1.082357 2.336169 -0.312896
H 2.469191 -3.121124 0.221263


