%chk=000211447.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211447

0 1
S 1.455283 2.160698 0.560555
O -2.202250 0.396496 -1.395024
O 2.300031 0.646893 -1.153816
O -3.611836 -0.769622 -0.075633
O 3.615738 -1.073424 -0.512372
N 0.049275 -2.566118 1.500627
C 0.040326 -0.174568 -0.063415
C -1.218076 -0.966895 0.232778
C 1.292660 -0.998988 0.170258
C -1.192206 -2.057145 1.050683
C 1.278451 -2.091353 0.986567
C 0.102233 1.057356 0.785191
C -2.464602 -0.483846 -0.370419
C 2.519037 -0.545367 -0.489684
C -2.371364 -2.832678 1.523824
C 2.465089 -2.882328 1.411138
C -0.725928 1.530380 1.752853
C -0.286768 2.786295 2.326727
C 0.870742 3.253593 1.793773
C -3.343764 0.976652 -2.103309
C 3.411672 1.199035 -1.934571
C -3.888386 -0.021575 -3.103996
C 3.550839 0.434249 -3.234617
H 0.012602 0.140761 -1.151474
H 0.055706 -3.339517 2.162168
H -2.434909 -2.877124 2.620073
H -2.384468 -3.860306 1.134506
H -3.328235 -2.366611 1.189105
H 2.799699 -2.594649 2.420353
H 3.339946 -2.689680 0.745522
H 2.306168 -3.967365 1.396611
H -1.633420 1.046171 2.084941
H -0.856260 3.274223 3.105239
H 1.410676 4.149698 2.035885
H -4.098662 1.290847 -1.360783
H -2.863827 1.853681 -2.575414
H 3.067443 2.240195 -2.075216
H 4.326488 1.162551 -1.317118
H -3.091066 -0.432047 -3.736615
H -4.637484 0.435526 -3.760149
H -4.367214 -0.870397 -2.592935
H 3.909609 -0.590377 -3.054146
H 4.263011 0.919736 -3.911216
H 2.589700 0.353843 -3.758452


%chk=000211447-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000211447

0 1
S 1.029159 2.617233 0.528195
O -2.239136 0.537886 -1.358940
O 2.265709 0.482284 -1.479966
O -3.627272 -0.995603 -0.285054
O 3.700024 -1.039498 -0.452002
N 0.069321 -2.334912 1.643391
C 0.044505 -0.067432 -0.015231
C -1.217217 -0.906440 0.220101
C 1.318651 -0.913484 0.183524
C -1.177175 -1.955300 1.122225
C 1.304501 -1.951980 1.097591
C 0.048045 1.139931 0.923369
C -2.469760 -0.511664 -0.452333
C 2.539162 -0.549269 -0.559722
C -2.328774 -2.815721 1.591643
C 2.473384 -2.779438 1.582389
C -0.617157 1.318570 2.129289
C -0.373395 2.593099 2.762968
C 0.483121 3.408923 2.043650
C -3.427690 1.038495 -2.106162
C 3.413964 0.958849 -2.301703
C -3.673726 0.203274 -3.366660
C 3.570402 0.106887 -3.565210
H 0.031029 0.307265 -1.049267
H 0.077652 -3.087137 2.334606
H -2.245380 -3.015220 2.677747
H -2.324161 -3.791746 1.068597
H -3.289283 -2.330014 1.375371
H 2.568005 -2.694840 2.683029
H 3.405929 -2.434205 1.117328
H 2.328620 -3.849231 1.336182
H -1.281836 0.558487 2.546564
H -0.821731 2.889246 3.714776
H 0.840914 4.409682 2.280285
H -4.303207 1.012685 -1.433857
H -3.161031 2.080588 -2.345778
H 3.148550 2.002553 -2.535951
H 4.327012 0.926591 -1.681946
H -2.774068 0.181204 -4.005972
H -4.502942 0.644354 -3.950945
H -3.950272 -0.830383 -3.100223
H 3.848089 -0.928062 -3.304752
H 4.368353 0.529027 -4.204474
H 2.632812 0.091366 -4.147667


