%chk=000246472.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246472

0 1
S 0.769729 0.620094 0.654187
O 1.080154 1.973847 0.242858
O 1.064460 0.231289 2.024577
N 1.563939 -0.468353 -0.404122
C 3.054919 -0.636222 -0.347890
C 3.487654 -1.298063 -1.671409
C 3.716146 0.740243 -0.201269
C 3.434616 -1.538651 0.842409
C -0.885534 0.259286 0.308695
C -1.631062 -0.520045 1.200020
C -1.492218 0.774421 -0.841440
C -3.581394 -0.294633 -0.224989
C -2.970708 -0.802591 0.935696
C -2.831917 0.495959 -1.113733
C -5.011202 -0.603369 -0.518120
H 1.086108 -1.340209 -0.651091
H 3.198322 -0.680141 -2.530363
H 4.574202 -1.426465 -1.707708
H 3.038173 -2.285410 -1.808936
H 3.618220 1.153323 0.811471
H 3.273412 1.483258 -0.882765
H 4.786938 0.693487 -0.420778
H 3.048947 -2.555006 0.734054
H 4.520077 -1.608918 0.957683
H 3.034957 -1.140169 1.789612
H -1.162215 -0.903257 2.115035
H -0.918101 1.405007 -1.529482
H -3.544687 -1.410067 1.632585
H -3.297504 0.898097 -2.011342
H -5.095473 -1.517107 -1.127140
H -5.602250 -0.769900 0.393495
H -5.509008 0.201563 -1.077298


%chk=000246472-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246472

0 1
S 0.800120 0.680841 0.774213
O 1.094629 2.220200 0.349735
O 1.056533 0.210757 2.323420
N 1.641398 -0.414170 -0.512696
C 3.135123 -0.627185 -0.374198
C 3.509935 -1.360033 -1.690739
C 3.847194 0.742853 -0.309274
C 3.497728 -1.498553 0.858817
C -0.986622 0.254576 0.340548
C -1.692894 -0.591329 1.209717
C -1.556781 0.844667 -0.799064
C -3.665377 -0.314210 -0.246895
C -3.043616 -0.869681 0.902830
C -2.907597 0.548681 -1.084364
C -5.108981 -0.642951 -0.580936
H 1.137782 -1.322641 -0.421438
H 3.263849 -0.733445 -2.564228
H 4.594889 -1.571852 -1.695357
H 2.974767 -2.323651 -1.786422
H 3.658299 1.258467 0.648290
H 3.501712 1.403222 -1.121642
H 4.936883 0.589658 -0.406620
H 3.024817 -2.497673 0.790938
H 4.591856 -1.644561 0.913625
H 3.157387 -1.016330 1.791431
H -1.206871 -0.987179 2.108016
H -0.970744 1.525013 -1.424631
H -3.622459 -1.520168 1.568562
H -3.380502 0.997216 -1.965613
H -5.166814 -1.522602 -1.251015
H -5.691189 -0.882149 0.325584
H -5.606755 0.195509 -1.098089


