%chk=000241861.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241861

0 1
S 2.310321 -1.074653 0.008354
S -3.018527 -0.256001 -0.113532
O 1.774339 -2.418373 -0.064746
O 3.364328 -0.646151 -0.889394
O -3.940271 0.860028 -0.026062
O -3.143184 -1.243007 -1.160321
N 2.977682 -0.903431 1.587851
N -3.161141 -1.127481 1.362768
C 0.994110 0.035383 -0.014527
C 1.193252 1.428251 0.002687
C -1.410918 0.365598 -0.063991
C -0.307806 -0.484220 -0.056641
C 0.070644 2.283204 -0.006675
C -1.214654 1.757360 -0.035863
C 2.556740 2.016232 0.036520
H -0.450589 -1.578603 -0.088303
H 0.215019 3.363277 0.008414
H -2.085266 2.429695 -0.038808
H 3.039981 1.862182 1.016577
H 3.233444 1.555734 -0.716784
H 2.572478 3.097330 -0.157835
H 2.720211 -1.591247 2.293127
H 3.976862 -0.720672 1.660910
H -3.726997 -0.725204 2.106831
H -3.346855 -2.127931 1.310742


%chk=000241861-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241861

0 1
S 2.471200 -1.123157 -0.102070
S -3.086352 -0.423746 -0.149123
O 1.831284 -2.615106 -0.224646
O 3.602434 -0.598914 -1.144858
O -4.097337 0.775378 -0.588344
O -2.963359 -1.844159 -0.930682
N 3.235699 -0.887460 1.562608
N -3.467694 -0.817594 1.607045
C 1.003663 0.084508 -0.012831
C 1.216841 1.482572 0.073051
C -1.359535 0.325612 -0.043958
C -0.254058 -0.534077 -0.080266
C 0.043844 2.285736 0.090269
C -1.248597 1.721100 0.034987
C 2.589250 2.113872 0.143424
H -0.349706 -1.621463 -0.184423
H 0.155037 3.373571 0.147306
H -2.148849 2.344122 0.027788
H 3.147345 1.721316 1.013072
H 3.185396 1.867470 -0.752898
H 2.511734 3.209007 0.233693
H 2.825621 -1.569860 2.223178
H 4.256932 -1.009040 1.446901
H -4.293942 -0.264227 1.889141
H -3.613647 -1.838159 1.682934


