%chk=000199149.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199149

0 1
S 0.787029 -0.510341 -1.891953
S 4.135993 -1.586250 0.669107
S -2.453612 0.605663 -2.388760
P -1.031499 0.185352 -1.184203
O -1.339719 -0.974567 -0.048419
O -0.435434 1.410754 -0.250132
C 1.749281 -0.765009 -0.329594
C 3.094293 -1.267549 -0.788466
C -2.729873 -1.344572 0.214682
C -1.372393 2.419975 0.240851
C -2.599739 -2.348210 1.345431
C -0.472489 3.376410 1.001665
C 4.755674 0.051959 1.101297
H 1.222942 -1.494285 0.322435
H 1.814728 0.192289 0.226813
H 3.600394 -0.564665 -1.479670
H 3.019579 -2.237456 -1.328303
H -3.306965 -0.451387 0.514186
H -3.162352 -1.798446 -0.698402
H -1.869534 2.913554 -0.617541
H -2.116047 1.936428 0.899945
H -3.575942 -2.750469 1.638298
H -1.957735 -3.191243 1.051772
H -2.133039 -1.895860 2.230683
H -1.037520 4.225899 1.401334
H 0.029807 2.872526 1.837951
H 0.320474 3.770726 0.349928
H 5.366018 0.484963 0.301359
H 5.391167 -0.057354 1.991528
H 3.948112 0.750168 1.345076


%chk=000199149-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000199149

0 1
S 0.758457 -0.559674 -1.968713
S 4.064393 -1.594316 0.997797
S -2.636916 0.802577 -2.505704
P -1.132871 0.384957 -1.154339
O -1.589909 -0.619661 0.206346
O -0.422411 1.673458 -0.235431
C 1.768136 -0.613435 -0.330545
C 2.968299 -1.537543 -0.547928
C -2.517058 -1.759556 -0.042665
C -1.349089 2.566570 0.530224
C -2.805669 -2.380252 1.321444
C -0.468330 3.634461 1.170274
C 4.964463 0.050496 0.803165
H 1.097761 -0.989701 0.457333
H 2.061113 0.422319 -0.107196
H 3.596726 -1.214518 -1.396253
H 2.653302 -2.580196 -0.718971
H -3.433939 -1.375564 -0.528804
H -2.025805 -2.481105 -0.724208
H -2.082866 3.001914 -0.175004
H -1.879913 1.957946 1.285537
H -3.490084 -3.240399 1.201234
H -1.876195 -2.737561 1.796344
H -3.282514 -1.645837 1.992540
H -1.095221 4.332006 1.756236
H 0.270567 3.176093 1.849379
H 0.070230 4.210418 0.399023
H 5.487228 0.083065 -0.166194
H 5.702260 0.094300 1.619460
H 4.267454 0.897742 0.894514


