%chk=000260083.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260083

0 1
S -2.115170 -1.675387 2.045733
S -4.909652 -1.192144 1.099910
O 1.165660 1.102367 0.751557
O -0.571308 -0.747620 -1.348051
O 1.552284 2.647582 -2.027421
O -0.574867 2.750684 -1.317858
N -2.653324 -0.866686 -0.351666
C -3.351161 -0.332470 -1.563734
C -0.730092 -1.356029 1.007322
C -1.201106 -0.954762 -0.342121
C 1.715406 -1.163491 0.616631
C 0.530914 -1.455984 1.439025
C -3.320245 -1.187939 0.810272
C 2.027277 0.155048 0.210060
C -3.504259 1.179573 -1.484020
C 2.567904 -2.197185 0.208008
C 3.123847 0.437545 -0.608674
C 3.679617 -1.926820 -0.595959
C 3.947389 -0.618160 -1.009275
C 1.264828 2.464691 0.308605
C 0.590729 2.619986 -1.048370
H -2.741091 -0.619647 -2.453774
H -4.342962 -0.832313 -1.657580
H 0.757881 -1.778155 2.465134
H -4.103104 1.489647 -0.617875
H -2.530023 1.690649 -1.405138
H -3.999871 1.570050 -2.380543
H 2.351961 -3.223252 0.509540
H 3.320868 1.450359 -0.958661
H 4.330307 -2.741073 -0.909704
H 4.805168 -0.415002 -1.651782
H 0.681230 2.996885 1.093585
H 2.313728 2.816979 0.298475
H 1.172138 2.696476 -2.948452


%chk=000260083-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260083

0 1
S -2.157023 -2.057329 1.832053
S -5.043683 -1.433183 0.907504
O 1.083694 1.000946 0.469819
O -0.597668 -0.228849 -1.317169
O 1.381272 2.110533 -2.366646
O -0.612901 3.020726 -1.584924
N -2.704480 -0.691104 -0.363916
C -3.426758 -0.004286 -1.466993
C -0.754752 -1.432594 0.822980
C -1.270607 -0.715985 -0.368751
C 1.802018 -1.276613 0.533558
C 0.546582 -1.728133 1.149216
C -3.377693 -1.320356 0.676713
C 2.060419 0.066082 0.105023
C -3.750516 1.463030 -1.125611
C 2.856211 -2.226887 0.408344
C 3.277272 0.394984 -0.536011
C 4.079411 -1.899873 -0.205066
C 4.276671 -0.587702 -0.695073
C 1.159247 2.393015 0.018105
C 0.522678 2.553766 -1.363192
H -2.766378 -0.063318 -2.348957
H -4.350393 -0.578411 -1.653147
H 0.683798 -2.451659 1.967095
H -4.376718 1.524577 -0.219179
H -2.829096 2.051151 -0.980773
H -4.313456 1.914704 -1.962470
H 2.682841 -3.247287 0.770454
H 3.444073 1.396730 -0.937527
H 4.862924 -2.656396 -0.311293
H 5.213606 -0.321855 -1.196398
H 0.550428 2.953499 0.741723
H 2.197113 2.772878 0.022906
H 0.902764 2.089601 -3.239199


