%chk=000239915.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239915

0 1
S -0.117593 -0.628982 -0.569426
O 0.091972 -1.086785 0.787002
O -0.334309 -1.570397 -1.643954
O 3.035362 3.000473 -0.118629
O 0.840719 2.808052 0.252801
N 1.329002 0.220965 -1.009780
C 3.670743 0.416292 -0.093944
C 2.182398 0.742023 0.073047
C 3.970325 -1.092976 0.047466
C 3.509843 -1.639295 1.401606
C 5.472269 -1.332890 -0.153386
C -1.305168 0.654594 -0.629735
C 1.903973 2.254296 0.080804
C -2.646006 0.174106 -0.174231
C -3.231742 0.708083 0.982902
C -3.329753 -0.802061 -0.918301
C -4.494829 0.268115 1.390401
C -4.590303 -1.235685 -0.503643
C -5.176505 -0.701187 0.649203
H 4.040459 0.787145 -1.070779
H 4.252649 0.988687 0.659223
H 1.836969 0.352845 1.084831
H 3.418919 -1.643109 -0.756314
H 1.852798 -0.080599 -1.839495
H 3.781135 -2.695061 1.516665
H 3.956082 -1.096905 2.240446
H 2.414459 -1.586913 1.512543
H 5.708961 -2.402251 -0.104601
H 6.070677 -0.836043 0.618256
H 5.816944 -0.967362 -1.126073
H -0.968024 1.548543 -0.036530
H -1.393590 1.086958 -1.654309
H -2.704923 1.459980 1.568429
H -2.873449 -1.233065 -1.812863
H 2.856194 3.980691 -0.115832
H -4.946133 0.682547 2.290951
H -5.116791 -1.995598 -1.080174
H -6.158932 -1.042427 0.969325


%chk=000239915-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239915

0 1
S -0.216186 -0.906780 -0.272749
O -0.269870 -0.767618 1.353855
O -0.285532 -2.373627 -0.982926
O 2.525067 2.649752 1.280170
O 0.618685 2.411870 -0.009120
N 1.423366 -0.141936 -0.863137
C 3.716619 0.441989 -0.096529
C 2.196731 0.499556 0.227919
C 4.330465 -0.985310 -0.095258
C 4.117819 -1.718191 1.250382
C 5.836889 -0.886381 -0.437839
C -1.540013 0.335068 -1.147006
C 1.680715 1.924789 0.434810
C -2.877253 0.177486 -0.526476
C -3.234017 0.964815 0.602580
C -3.810369 -0.763200 -1.042698
C -4.506504 0.823538 1.193245
C -5.081641 -0.903475 -0.449277
C -5.432697 -0.109237 0.668497
H 3.888274 0.921367 -1.080271
H 4.237205 1.056025 0.660942
H 2.018153 -0.003728 1.206558
H 3.853182 -1.592894 -0.895576
H 1.926105 -0.964579 -1.249308
H 4.638052 -2.693151 1.245437
H 4.524995 -1.121514 2.089181
H 3.051471 -1.919557 1.460029
H 6.295647 -1.890378 -0.490813
H 6.376317 -0.309022 0.337435
H 6.000420 -0.385079 -1.410004
H -1.023761 1.290242 -0.970167
H -1.444014 -0.016123 -2.184997
H -2.509079 1.677455 1.011539
H -3.532367 -1.385009 -1.901686
H 2.124923 3.544040 1.456410
H -4.776536 1.432703 2.062582
H -5.795936 -1.629834 -0.851653
H -6.420524 -0.219269 1.129820


