%chk=000246994.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246994

0 1
S 3.271770 -0.421119 0.688485
O 0.465743 -2.230013 -0.241361
N 0.186895 0.051943 -0.487899
N 3.019974 2.412508 0.547943
C -1.215581 0.161032 -0.193568
C -1.767786 1.459456 -0.188503
C -2.021210 -0.958068 0.069733
C 0.935304 -1.135615 -0.472653
C -3.127139 1.620748 0.078539
C -3.379717 -0.771370 0.334980
C -3.937529 0.510283 0.339933
C 2.406138 -0.950951 -0.798494
C 3.108591 1.261679 0.577955
H 0.662033 0.939209 -0.673174
H -1.149422 2.331985 -0.385183
H -1.594908 -1.966459 0.071822
H -3.558732 2.621653 0.084257
H -4.007523 -1.638993 0.540355
H 2.835193 -1.942371 -1.090631
H 2.586998 -0.297915 -1.673412
H -4.996492 0.644877 0.547475


%chk=000246994-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246994

0 1
S 3.435978 -0.184372 0.663576
O 0.480923 -2.392823 -0.372209
N 0.211326 -0.051925 -0.423147
N 2.537028 2.583858 0.237475
C -1.184762 0.101910 -0.160751
C -1.675340 1.431983 -0.059581
C -2.071065 -0.996592 -0.005960
C 0.950967 -1.222115 -0.490950
C -3.041701 1.663462 0.192861
C -3.437116 -0.744931 0.248123
C -3.932364 0.575084 0.348266
C 2.446170 -1.023500 -0.773847
C 2.912964 1.455563 0.404662
H 0.725457 0.829709 -0.525627
H -0.986723 2.279854 -0.169662
H -1.688580 -2.015579 -0.082747
H -3.408744 2.692455 0.271178
H -4.118872 -1.594198 0.368161
H 2.917207 -2.013559 -0.859339
H 2.644215 -0.426800 -1.679423
H -4.994367 0.755017 0.545541


