%chk=000295856.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295856

0 1
S -1.141444 0.576422 0.097417
O 5.011846 -2.099806 0.516674
N 0.869393 -1.158473 0.275545
N 2.483767 -2.836811 0.432187
N 5.666532 0.047624 0.445312
N 0.787581 3.662853 0.041557
C -2.037920 -1.010897 0.130899
C -3.473128 -0.612792 0.043449
C 0.545231 0.136563 0.198325
C 3.254580 -0.496961 0.356987
C 1.505207 1.191968 0.193453
C 2.856034 0.842511 0.274150
C 2.222862 -1.502775 0.356176
C -4.093406 -0.480071 -1.209503
C -4.210343 -0.369249 1.213675
C -5.438603 -0.110880 -1.287525
C -5.555189 -0.000430 1.128126
C -6.171543 0.128672 -0.120686
C 4.665220 -0.917816 0.443905
C 1.101321 2.550934 0.109431
H -1.796127 -1.573721 1.055334
H -1.712279 -1.658395 -0.708474
H 3.605008 1.640680 0.271509
H -3.526988 -0.659866 -2.122248
H -3.735052 -0.462651 2.189183
H -5.916187 -0.007369 -2.260949
H -6.123652 0.189158 2.037665
H -7.219196 0.417221 -0.184443
H 3.454152 -3.178093 0.494541
H 1.733560 -3.512274 0.428954
H 5.499501 1.034223 0.390167
H 6.630859 -0.248099 0.504908


%chk=000295856-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000295856

0 1
S -1.118097 0.894040 0.139095
O 4.939230 -2.291227 0.476633
N 0.869789 -0.979801 0.290247
N 2.351953 -2.771872 0.414359
N 5.740036 -0.136232 0.411218
N 1.139939 3.909925 0.092291
C -2.022891 -0.801624 0.179175
C -3.508529 -0.566614 0.063715
C 0.608587 0.337873 0.225340
C 3.296052 -0.504612 0.349201
C 1.649244 1.334424 0.218259
C 2.984338 0.870215 0.281702
C 2.171522 -1.423842 0.351469
C -4.134234 -0.520709 -1.209295
C -4.303961 -0.389265 1.225557
C -5.525995 -0.307462 -1.319016
C -5.696018 -0.175603 1.118297
C -6.310865 -0.134372 -0.154911
C 4.687344 -1.031465 0.415832
C 1.363019 2.734303 0.149328
H -1.730234 -1.279201 1.126203
H -1.607562 -1.383986 -0.656742
H 3.772529 1.630112 0.275725
H -3.527040 -0.650464 -2.113257
H -3.828851 -0.417355 2.213621
H -5.997142 -0.276107 -2.307667
H -6.298954 -0.041760 2.023230
H -7.390705 0.031201 -0.239220
H 3.328932 -3.109290 0.459414
H 1.530270 -3.373753 0.413460
H 5.629712 0.872954 0.364815
H 6.680177 -0.527034 0.457620


