%chk=000214468.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214468

0 1
S 2.500397 0.882837 -0.968220
O 3.685599 0.283646 -1.553938
O 1.601313 1.701284 -1.760879
O -2.665136 -1.832800 1.473500
N 3.050209 1.882490 0.329430
N -0.599325 -3.460262 1.567642
C 1.573534 -0.373193 -0.233097
C -0.564653 -1.218392 0.591564
C 0.216993 -0.205927 0.009419
C 2.190799 -1.605996 0.073909
C 0.082575 -2.447800 0.949806
C 1.474770 -2.624556 0.659819
C -2.004624 -1.025844 0.831884
C 4.032962 1.254437 1.241001
C 1.999916 2.665707 1.018256
C -2.669432 0.196357 0.276088
C -3.308270 1.082869 1.153236
C -2.698983 0.425195 -1.106357
C -3.955466 2.213490 0.646629
C -3.353413 1.553611 -1.607447
C -3.977028 2.449411 -0.731929
H -0.261948 0.747817 -0.262711
H 3.253440 -1.747120 -0.166387
H 1.956093 -3.569301 0.898024
H 4.839995 0.789487 0.640650
H 3.604988 0.498963 1.918480
H 4.513690 2.032747 1.860221
H 1.368813 3.174008 0.262147
H 2.469904 3.464533 1.619578
H 1.356586 2.073108 1.687330
H -0.155667 -4.332927 1.794818
H -1.596225 -3.363369 1.797712
H -3.306146 0.884277 2.225364
H -2.215843 -0.273956 -1.789952
H -4.448386 2.907070 1.326267
H -3.372887 1.736925 -2.681571
H -4.482143 3.331074 -1.125687


%chk=000214468-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214468

0 1
S 2.595694 0.957732 -1.015943
O 3.810502 0.204455 -1.793528
O 1.558443 1.980899 -1.742696
O -2.679416 -1.679454 1.744572
N 3.453433 1.998624 0.327974
N -0.684805 -3.377199 1.675487
C 1.562650 -0.389381 -0.203961
C -0.593091 -1.135216 0.669301
C 0.221917 -0.127322 0.081587
C 2.165089 -1.644469 0.050002
C 0.026643 -2.404397 1.020658
C 1.397600 -2.637167 0.663496
C -2.031729 -0.899214 0.948834
C 4.364055 1.148185 1.128718
C 2.458154 2.771870 1.105998
C -2.783716 0.231833 0.308660
C -3.837380 0.828350 1.054276
C -2.558150 0.655325 -1.030181
C -4.621902 1.853338 0.490326
C -3.356844 1.671246 -1.598483
C -4.381701 2.280194 -0.838542
H -0.196144 0.856319 -0.151752
H 3.203432 -1.825288 -0.247215
H 1.843308 -3.612897 0.888125
H 4.984211 0.547003 0.443394
H 3.842295 0.482861 1.854145
H 5.034215 1.823592 1.690904
H 1.745510 3.239828 0.406680
H 3.005663 3.579381 1.625408
H 1.906957 2.172568 1.866168
H -0.265703 -4.283927 1.870851
H -1.641654 -3.132266 1.976773
H -4.026939 0.468121 2.070623
H -1.789711 0.172719 -1.642218
H -5.421354 2.315952 1.079136
H -3.178512 1.983532 -2.632774
H -4.994021 3.074172 -1.280202


