%chk=000258072.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258072

0 1
S 0.950774 0.444129 -0.824155
O 0.608484 -0.502158 -1.862166
O 0.850709 1.871687 -1.078320
N -0.007675 0.097915 0.575120
C -1.435071 -0.017079 0.363904
C -2.286313 1.105169 0.506025
C -1.975009 -1.285939 0.048832
C -4.211714 -0.317717 0.069985
C -3.668473 0.940857 0.366177
C -3.363116 -1.419603 -0.093185
C 2.540728 0.108913 -0.219564
C -1.723709 2.459650 0.788099
C -1.090604 -2.468805 -0.160421
C -5.689124 -0.476610 -0.093694
C 2.924352 -1.207425 0.051427
C 3.443922 1.159195 -0.027045
C 4.212104 -1.474788 0.527533
C 4.731463 0.894069 0.447552
C 5.113647 -0.423488 0.725201
H 0.192066 0.658146 1.417213
H -4.326083 1.799328 0.478360
H -3.783003 -2.392121 -0.339431
H -2.484035 3.250015 0.734705
H -0.944676 2.732941 0.047452
H -1.271757 2.518340 1.785599
H -0.503777 -2.334645 -1.092223
H -0.369373 -2.583202 0.660253
H -1.644831 -3.408712 -0.255215
H -6.034726 -1.479251 0.190419
H -6.256596 0.243449 0.510111
H -5.978272 -0.319275 -1.144033
H 2.223019 -2.031780 -0.110666
H 3.144342 2.189773 -0.254174
H 4.512513 -2.499737 0.739573
H 5.436334 1.710650 0.596567
H 6.118780 -0.631390 1.094588


%chk=000258072-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258072

0 1
S 1.035268 0.834399 -0.789301
O 0.448495 -0.093992 -1.997845
O 1.268553 2.449016 -0.988545
N -0.162431 0.495395 0.897200
C -1.507024 0.216621 0.552741
C -2.504592 1.254752 0.486268
C -1.869762 -1.153654 0.322277
C -4.228201 -0.459705 0.044236
C -3.844430 0.892342 0.254068
C -3.226340 -1.460619 0.081896
C 2.693882 0.109237 -0.247450
C -2.114863 2.712147 0.661148
C -0.823176 -2.245265 0.334685
C -5.673072 -0.816490 -0.247236
C 2.914821 -1.265520 -0.428602
C 3.645055 0.990410 0.291700
C 4.168995 -1.785889 -0.034554
C 4.893098 0.450538 0.681448
C 5.150058 -0.931768 0.523331
H -0.065849 1.456081 1.289236
H -4.610628 1.676661 0.218082
H -3.509580 -2.508022 -0.080028
H -2.983205 3.369637 0.491187
H -1.319788 3.009717 -0.048584
H -1.742778 2.925792 1.683679
H -0.323234 -2.293458 -0.652084
H -0.044325 -2.033424 1.087070
H -1.275116 -3.231155 0.538055
H -5.912851 -1.842103 0.083413
H -6.372383 -0.120628 0.248622
H -5.878007 -0.766646 -1.334897
H 2.146934 -1.897599 -0.885287
H 3.423915 2.059555 0.373780
H 4.377870 -2.852617 -0.166574
H 5.660580 1.109194 1.101180
H 6.119411 -1.342440 0.826089


