%chk=000257153.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257153

0 1
S 0.216775 1.322719 1.320135
O -0.323625 -2.345899 0.637566
O 3.144624 0.114661 -0.843409
N 1.311610 -1.002073 -0.139468
C -1.681569 0.413968 -0.536491
C -0.850044 0.005289 0.700334
C -2.569150 -0.755078 -0.978756
C -2.540000 1.643245 -0.230633
C 0.017388 -1.201962 0.426852
C 1.361883 1.507275 -0.051718
C 2.030739 0.204324 -0.373387
H -0.982806 0.661166 -1.375555
H -1.551996 -0.248402 1.543634
H -3.299205 -1.032563 -0.208664
H -3.134814 -0.502078 -1.882904
H -1.988994 -1.659792 -1.202640
H -3.226523 1.468819 0.606342
H -3.156214 1.915242 -1.096638
H -1.936731 2.523214 0.023124
H 2.128409 2.265526 0.238931
H 0.869646 1.926905 -0.955731
H 1.839498 -1.872606 -0.341324


%chk=000257153-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257153

0 1
S 0.261862 1.511388 1.362569
O -0.396532 -2.304501 0.883888
O 3.111176 -0.023260 -1.041897
N 1.249718 -1.025822 -0.107534
C -1.694002 0.473481 -0.522591
C -0.850354 0.094673 0.736468
C -2.454798 -0.758983 -1.074993
C -2.681965 1.611960 -0.180010
C -0.004338 -1.158092 0.541666
C 1.455524 1.486727 -0.092922
C 2.008998 0.112538 -0.447704
H -1.002717 0.830718 -1.313124
H -1.532270 -0.115565 1.578604
H -3.111342 -1.198609 -0.301790
H -3.087122 -0.451318 -1.927285
H -1.773675 -1.554033 -1.424854
H -3.430842 1.265660 0.557787
H -3.225828 1.932242 -1.086922
H -2.161712 2.489691 0.241803
H 2.306055 2.128921 0.181991
H 0.972592 1.924806 -0.984119
H 1.720474 -1.920721 -0.299432


