%chk=000239908.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239908

0 1
S -0.086929 -1.546067 0.609341
O -0.845627 0.999628 0.792952
O -5.244482 1.422364 -0.310882
O -4.897011 -0.790231 -0.160137
N -2.093703 -0.335437 -0.615848
C 2.351869 -0.412829 0.768379
C 1.237409 -0.857364 1.654360
C 2.325544 0.875615 0.208912
C 3.426917 -1.271068 0.491111
C 3.367779 1.298340 -0.617961
C 4.466857 -0.840656 -0.337952
C 4.440376 0.442473 -0.892390
C -3.086444 0.707538 -0.919012
C -1.080954 -0.076656 0.295707
C -4.458997 0.302611 -0.418886
H 1.536987 -1.654357 2.364723
H 0.837485 -0.018700 2.269807
H 1.483889 1.541437 0.417788
H 3.453900 -2.272498 0.915434
H 3.344738 2.297563 -1.050321
H 5.299499 -1.508678 -0.552141
H 5.251660 0.775068 -1.536595
H -3.134435 0.882043 -2.023413
H -2.780838 1.691273 -0.464874
H -2.327425 -1.282567 -0.920050
H -6.167665 1.220054 0.006248


%chk=000239908-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239908

0 1
S -0.137586 -1.533162 0.919091
O -0.820473 1.155464 1.122782
O -5.488185 1.238268 -1.110243
O -4.679323 -0.942726 -1.201335
N -2.355479 -0.236771 0.065051
C 2.483813 -0.370639 0.716574
C 1.402592 -0.709853 1.712317
C 2.477542 0.886098 0.055137
C 3.527370 -1.290032 0.435166
C 3.493265 1.211793 -0.870352
C 4.543282 -0.964905 -0.490889
C 4.528960 0.288128 -1.146815
C -3.321969 0.834905 -0.168603
C -1.169722 0.016069 0.710084
C -4.535736 0.255079 -0.871142
H 1.730128 -1.442791 2.466204
H 0.995154 0.188050 2.206303
H 1.671136 1.596695 0.270928
H 3.542145 -2.262724 0.942712
H 3.480368 2.185755 -1.372697
H 5.344714 -1.683103 -0.698058
H 5.317582 0.542817 -1.863865
H -2.891666 1.644690 -0.789073
H -3.638918 1.311225 0.779174
H -2.602017 -1.173506 -0.271361
H -6.276578 0.844075 -1.572792


