%chk=000290850.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290850

0 1
S 2.791905 1.424957 -1.654747
O 3.541867 -0.504749 0.743481
O -4.377804 -1.269109 -0.371799
O -4.880698 0.481835 0.941113
N -2.493729 0.885479 -0.992675
C -4.882576 0.081564 -0.423076
C 1.729983 0.592489 -0.545159
C -3.940294 1.075227 -1.135388
C 2.205520 -0.235393 0.473719
C -0.537960 0.119287 0.169776
C 0.353701 0.770843 -0.698773
C 4.372742 0.940745 -1.092312
C 4.556861 0.074393 -0.012681
C 1.332052 -0.897593 1.352704
C -0.038428 -0.712320 1.191655
C -2.003913 0.283689 0.043626
C -4.226548 -1.958767 -1.628759
C -5.709274 -0.333029 1.827392
C 5.492637 1.446031 -1.759797
C 5.837271 -0.304931 0.421871
C 6.774529 1.078534 -1.340548
C 6.943603 0.207581 -0.255565
C -5.568686 -2.262076 -2.274706
C -5.602456 0.372157 3.165581
H -5.908382 0.069318 -0.839389
H -4.189752 2.108328 -0.782416
H -4.151936 1.060398 -2.231024
H -0.042911 1.414138 -1.493300
H 1.736043 -1.536561 2.135745
H -0.729899 -1.221006 1.865780
H -2.600250 -0.148233 0.872830
H -3.560371 -1.375333 -2.288719
H -3.705472 -2.879092 -1.296833
H -6.738176 -0.350768 1.431949
H -5.287866 -1.353876 1.839984
H 5.369719 2.125150 -2.605599
H 5.943197 -0.982087 1.267022
H 7.646345 1.471641 -1.860196
H 7.947452 -0.073136 0.063905
H -5.468455 -3.030270 -3.051275
H -6.285414 -2.638901 -1.533070
H -6.015622 -1.380985 -2.746520
H -6.159061 -0.160023 3.944218
H -4.554555 0.450388 3.487373
H -5.987440 1.399065 3.108102


%chk=000290850-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290850

0 1
S 2.913352 0.603002 -2.183819
O 3.725922 -0.808680 0.555207
O -4.570018 -1.400057 -0.353226
O -4.777383 0.423045 1.095620
N -2.422964 0.691786 -1.003241
C -4.858775 0.044546 -0.290300
C 1.826196 0.115663 -0.784706
C -3.874673 0.924536 -1.099219
C 2.350570 -0.533635 0.362191
C -0.439468 -0.127480 0.128073
C 0.442285 0.328768 -0.889450
C 4.508624 0.693139 -1.282116
C 4.720127 -0.016979 -0.078053
C 1.490031 -0.981353 1.384152
C 0.099925 -0.789161 1.262021
C -1.900235 0.079207 0.026861
C -4.500209 -1.985508 -1.705922
C -5.807567 -0.211550 1.952041
C 5.571301 1.436676 -1.841209
C 5.978222 0.000409 0.556774
C 6.839789 1.447314 -1.218314
C 7.043745 0.724849 -0.019842
C -5.832579 -1.946610 -2.475686
C -5.695492 0.423838 3.336174
H -5.897293 0.218076 -0.667655
H -4.073279 1.975236 -0.805695
H -4.141704 0.851987 -2.171656
H 0.006338 0.839173 -1.754725
H 1.930808 -1.476538 2.254065
H -0.571567 -1.145800 2.051413
H -2.507034 -0.310166 0.864312
H -3.691703 -1.495171 -2.286511
H -4.198067 -3.029841 -1.518109
H -6.808982 -0.030460 1.502292
H -5.630735 -1.302399 1.982601
H 5.406153 1.999546 -2.766290
H 6.098518 -0.560002 1.488585
H 7.658779 2.018318 -1.667267
H 8.023353 0.729361 0.468898
H -5.733985 -2.519725 -3.416485
H -6.641718 -2.402477 -1.878021
H -6.132629 -0.917412 -2.744398
H -6.441131 -0.018302 4.022023
H -4.690117 0.253128 3.758723
H -5.867233 1.512705 3.283387


