%chk=000221243.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221243

0 1
S 0.782834 -1.648786 0.000581
O 1.528438 -2.569010 0.827357
O 0.224547 -2.040065 -1.269102
N -0.506012 -1.160881 1.044237
N 3.487611 1.236061 0.537847
N -3.021815 0.581139 -1.073885
C 1.687466 -0.198819 -0.209013
C -1.633092 -0.398725 0.660371
C 1.392588 0.688697 -1.250171
C 2.750962 0.105232 0.660317
C -2.428408 0.216401 1.651645
C -1.988567 -0.205018 -0.701313
C 2.147946 1.855717 -1.387462
C -3.502756 1.012092 1.259872
C 3.185112 2.097921 -0.471881
C -3.763500 1.183735 -0.110836
H -0.514199 -1.502751 2.014748
H 0.581914 0.471677 -1.957245
H 3.036585 -0.576162 1.480239
H -2.206926 0.075575 2.707559
H -1.460545 -0.722017 -1.520778
H 1.938614 2.563632 -2.188075
H -4.131715 1.496171 2.004866
H 3.806186 3.002184 -0.532989
H -4.590466 1.809800 -0.460590


%chk=000221243-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221243

0 1
S 0.678419 -1.396947 0.424492
O 1.498374 -2.392114 1.419589
O -0.188950 -1.946009 -0.844396
N -0.463363 -0.321385 1.678645
N 3.819338 1.276065 0.071442
N -2.859506 1.763388 -0.251901
C 1.853802 -0.078711 -0.243746
C -1.705303 0.092357 1.126752
C 1.621290 0.416705 -1.536586
C 2.942963 0.339992 0.541623
C -2.940453 -0.567334 1.380443
C -1.727892 1.257961 0.304353
C 2.534096 1.382910 -2.018244
C -4.124222 -0.030695 0.835265
C 3.603893 1.780690 -1.181780
C -4.038255 1.121299 0.017911
H -0.569948 -1.026008 2.438055
H 0.779180 0.049686 -2.132681
H 3.130398 -0.071184 1.538192
H -2.964059 -1.477358 1.992129
H -0.796622 1.803893 0.112404
H 2.419214 1.814092 -3.016872
H -5.093884 -0.503240 1.019430
H 4.328045 2.530376 -1.518339
H -4.933752 1.555372 -0.439883


