%chk=000214801.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214801

0 1
S 0.472975 -0.876499 -0.907188
O 4.460531 -1.732387 0.103173
O 4.435444 0.309635 1.020943
N -0.042901 1.349707 0.306958
C 1.801040 0.211571 -0.607894
C 1.349963 1.336121 0.045764
C -0.650441 0.264844 -0.122403
C 3.164515 -0.133648 -1.047886
C -2.070061 -0.052379 -0.039062
C 2.164940 2.486859 0.494053
C -3.014301 0.989969 -0.087891
C -2.502808 -1.383379 0.091149
C 4.051860 -0.420160 0.139083
C -4.377941 0.697588 -0.020514
C -3.869391 -1.664821 0.158512
C -4.806987 -0.628242 0.100199
H 3.611656 0.713020 -1.626831
H 3.170924 -1.005038 -1.747187
H 2.463525 3.123876 -0.351023
H 1.617937 3.127130 1.205684
H 3.089293 2.148504 1.001443
H -2.673281 2.024333 -0.171773
H -1.782187 -2.199474 0.151094
H -5.107645 1.505513 -0.059503
H -4.204597 -2.696322 0.259503
H -5.871460 -0.853545 0.152032
H 5.043799 -1.979175 0.871065


%chk=000214801-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214801

0 1
S 0.610192 -1.099348 -0.764394
O 4.024604 -1.825122 0.669560
O 4.750165 0.352237 1.043639
N -0.040988 1.362309 0.023491
C 1.890333 0.167998 -0.615585
C 1.344820 1.376839 -0.184915
C -0.605296 0.185757 -0.218960
C 3.334596 -0.152684 -0.928510
C -2.034270 -0.118209 -0.082248
C 2.100674 2.655039 0.070806
C -2.920360 0.916724 0.334706
C -2.562895 -1.410101 -0.352874
C 4.117529 -0.467626 0.344765
C -4.297897 0.659341 0.474861
C -3.942841 -1.661973 -0.211472
C -4.817063 -0.629501 0.202660
H 3.814596 0.718351 -1.404775
H 3.406587 -1.010606 -1.616054
H 1.774788 3.444468 -0.630869
H 1.888041 3.017319 1.092084
H 3.189725 2.518080 -0.017416
H -2.503317 1.907358 0.540301
H -1.896394 -2.220244 -0.673114
H -4.969769 1.462887 0.796210
H -4.336774 -2.661989 -0.423088
H -5.889098 -0.826864 0.312053
H 4.494712 -1.996840 1.530639


