%chk=000208278.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208278

0 1
S -0.622418 -2.127819 -0.307316
O 3.143357 2.161334 0.364064
O 2.552029 -2.271234 -0.789860
N 0.992783 1.341510 0.435052
N 2.868013 -0.069611 -0.212289
N -1.244249 0.337892 0.453132
N -3.103935 -1.212715 0.395470
C 0.140874 0.263322 0.251507
C 0.649625 -0.976502 -0.163160
C 2.415200 1.201441 0.202002
C 2.027910 -1.241086 -0.425806
C -1.801208 -0.872884 0.207432
C 0.466443 2.657099 0.877818
C 4.335194 -0.201882 -0.427863
C -4.138964 -0.186252 0.698304
C -4.827892 0.283176 -0.557286
C -4.257222 1.126770 -1.413956
H -0.255509 3.048618 0.139955
H 1.297076 3.381900 0.985895
H -0.048473 2.555808 1.849617
H 4.724918 0.663085 -0.992131
H 4.544410 -1.128143 -0.997114
H 4.863759 -0.256483 0.538783
H -3.447897 -2.091082 0.007906
H -3.668417 0.676607 1.235710
H -4.862337 -0.643223 1.412617
H -5.830380 -0.114403 -0.713178
H -4.739714 1.473472 -2.318197
H -3.260173 1.533586 -1.276209


%chk=000208278-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208278

0 1
S -0.556571 -2.392021 -0.169410
O 3.104186 2.204006 0.216532
O 2.700474 -2.422737 -0.583336
N 0.957016 1.259693 0.318735
N 2.886066 -0.094423 -0.176918
N -1.212008 0.182864 0.395275
N -3.080031 -1.306990 0.376191
C 0.163173 0.125906 0.210664
C 0.725997 -1.118012 -0.091304
C 2.363883 1.183108 0.123930
C 2.131078 -1.323616 -0.307983
C -1.749496 -1.032017 0.238911
C 0.350281 2.568806 0.635467
C 4.351598 -0.160323 -0.375739
C -4.084880 -0.238679 0.602887
C -4.605482 0.365151 -0.691379
C -4.449864 1.667357 -1.031774
H -0.390428 2.839064 -0.135258
H 1.163394 3.308806 0.659141
H -0.155047 2.526491 1.614495
H 4.649707 0.487335 -1.216655
H 4.603031 -1.209715 -0.588151
H 4.872097 0.188339 0.531239
H -3.403017 -2.261748 0.221831
H -3.612916 0.540314 1.223557
H -4.913722 -0.688960 1.181620
H -5.134362 -0.320146 -1.370391
H -4.847959 2.067097 -1.971118
H -3.913396 2.367353 -0.380159


