%chk=000290217.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290217

0 1
S 3.187961 -0.289150 -0.000158
O -1.739820 -0.105576 0.000214
O -0.211528 -2.163267 0.000191
O -0.852272 1.971977 -0.000069
N 1.948955 2.155278 -0.000056
C 0.603967 0.092426 0.000040
C 1.805935 0.814438 -0.000080
C 0.858391 -1.329378 0.000068
C -0.680179 0.756389 0.000101
C 2.176092 -1.699248 -0.000049
C -3.076869 0.514128 0.000182
C -4.014442 -0.673874 0.000256
H -3.155679 1.142511 0.903495
H -3.155693 1.142412 -0.903196
H 2.598695 -2.682466 -0.000051
H -5.062533 -0.355159 0.000306
H -3.848576 -1.311313 -0.879732
H -3.848480 -1.311273 0.880257
H 1.108990 2.748456 -0.000084
H 2.847679 2.605262 -0.000327
H 0.067805 -3.118474 0.000193


%chk=000290217-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000290217

0 1
S 3.309957 -0.205202 -0.000649
O -1.761478 -0.148370 0.000492
O -0.086183 -2.357853 0.000502
O -0.791017 1.967900 -0.000142
N 1.867249 2.167003 -0.000089
C 0.633583 0.017959 0.000232
C 1.812482 0.803184 -0.000157
C 0.941438 -1.408773 0.000170
C -0.658617 0.694284 0.000569
C 2.289848 -1.708845 -0.000239
C -3.094152 0.528933 0.000170
C -4.139702 -0.581969 0.000152
H -3.160985 1.175330 0.894199
H -3.160692 1.175084 -0.894058
H 2.782714 -2.678763 -0.000365
H -5.154295 -0.143035 -0.000047
H -4.032348 -1.219993 -0.893502
H -4.032603 -1.219768 0.893997
H 0.946212 2.636624 0.000334
H 2.745022 2.679582 -0.000466
H 0.301965 -3.269216 0.000401


