%chk=000278602.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278602

0 1
O -0.697237 3.356997 0.440609
O -0.535253 2.523043 -1.630895
O 3.630094 -2.087907 0.890355
O 4.062956 -0.362582 -0.467009
C -0.024413 1.098308 0.334825
C 1.373583 0.657201 -0.141275
C -1.058359 0.009992 0.142634
C 1.880716 -0.538397 0.666722
C -0.433221 2.336666 -0.443442
C -1.594533 -0.637352 1.265057
C -1.468640 -0.368778 -1.144280
C 3.274607 -0.911321 0.263555
C -2.531403 -1.661403 1.097662
C -2.405808 -1.391818 -1.304739
C -2.936973 -2.041341 -0.185337
H 0.032669 1.377252 1.424196
H 1.346221 0.402516 -1.223652
H 2.089615 1.502899 -0.056892
H 1.203577 -1.416944 0.539622
H 1.860480 -0.326652 1.759249
H -1.289779 -0.344954 2.268291
H -1.064678 0.146610 -2.019744
H -2.947250 -2.162528 1.970789
H -2.724204 -1.681933 -2.305613
H -3.666897 -2.838944 -0.313079
H -0.980466 4.198203 -0.009867
H 4.551298 -2.382934 0.660458


%chk=000278602-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278602

0 1
O -0.982724 3.309120 0.524712
O -0.298022 2.607857 -1.579145
O 3.784358 -2.068695 0.949186
O 3.971473 -0.536780 -0.785476
C 0.017639 1.111023 0.377208
C 1.424017 0.674421 -0.124255
C -1.051921 0.025570 0.171569
C 1.936899 -0.561853 0.634789
C -0.409885 2.380505 -0.354537
C -1.705817 -0.551287 1.287935
C -1.383905 -0.427058 -1.131823
C 3.307100 -1.005323 0.163903
C -2.669920 -1.570008 1.110137
C -2.347772 -1.443457 -1.309775
C -2.992661 -2.020280 -0.190233
H 0.066636 1.355073 1.453338
H 1.384114 0.468268 -1.207700
H 2.135406 1.511514 0.003400
H 1.244150 -1.417261 0.514752
H 1.994932 -0.375750 1.724950
H -1.463393 -0.200150 2.298383
H -0.900931 0.028788 -2.004046
H -3.167158 -2.008087 1.982738
H -2.598907 -1.782744 -2.320964
H -3.740529 -2.808634 -0.330537
H -1.285233 4.106137 0.008629
H 4.678755 -2.347011 0.611063


