%chk=000198776.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198776

0 1
S -3.525122 0.202500 -0.119527
F 5.360559 -0.801003 0.051357
O -1.427807 3.409587 0.256805
O -3.564613 3.043934 0.156938
N 0.248458 1.289408 0.100028
N -2.408385 2.657687 0.153923
C -1.109643 -0.845096 -0.149168
C -0.926189 0.605383 -0.001964
C -2.481141 -1.194127 -0.224566
C -2.158908 1.276159 0.026473
C -0.147418 -1.866489 -0.219938
C 1.567751 0.704461 0.083022
C -2.903721 -2.516485 -0.366471
C -0.562862 -3.187386 -0.361412
C -1.931549 -3.511710 -0.434341
C 2.244942 0.572578 -1.142176
C 2.170116 0.332686 1.297971
C 3.541775 0.058316 -1.157548
C 3.466649 -0.182474 1.291682
C 4.122805 -0.307667 0.061887
H 0.201493 2.331633 0.200358
H 0.916331 -1.637100 -0.165561
H -3.963616 -2.762226 -0.422478
H 0.177171 -3.985166 -0.416966
H -2.228870 -4.555706 -0.545260
H 1.760545 0.872184 -2.074271
H 1.628236 0.448114 2.239375
H 4.085665 -0.049541 -2.097382
H 3.953146 -0.474356 2.223809


%chk=000198776-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198776

0 1
S -3.603540 0.237469 0.299240
F 5.611323 -0.432450 0.450317
O -1.171736 3.358064 -0.324389
O -3.395525 3.172591 0.260408
N 0.273813 1.138610 -0.405822
N -2.246317 2.637072 -0.015003
C -1.188518 -0.947172 -0.143239
C -0.922401 0.494926 -0.174258
C -2.566042 -1.240370 0.117848
C -2.119837 1.234509 0.001210
C -0.304837 -2.031508 -0.410978
C 1.604433 0.671588 -0.195968
C -3.051529 -2.562564 0.169021
C -0.786898 -3.351124 -0.372427
C -2.149869 -3.619236 -0.069625
C 2.626788 1.161479 -1.051052
C 1.944861 -0.172883 0.894979
C 3.972868 0.800154 -0.836778
C 3.285149 -0.552999 1.107832
C 4.271282 -0.059132 0.234921
H 0.127501 2.162488 -0.553437
H 0.743078 -1.843404 -0.655066
H -4.106865 -2.766031 0.375920
H -0.104670 -4.181085 -0.581957
H -2.507880 -4.653549 -0.035798
H 2.362200 1.817982 -1.886227
H 1.169179 -0.512888 1.587405
H 4.772491 1.166929 -1.486148
H 3.567295 -1.199366 1.943672


