%chk=000231312.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231312

0 1
O 0.114053 -1.982938 0.969790
O 3.031690 0.506716 0.447159
O 1.293366 1.059147 -0.893887
N -1.460356 -0.327661 0.875036
C -1.808874 1.106402 0.625331
C -0.753738 2.102124 1.157226
C -2.037510 1.326060 -0.887978
C 0.283266 1.459071 2.077300
C -2.488054 -1.289190 0.372837
C -3.111519 0.376279 -1.430331
C 0.917005 0.236737 1.401360
C -2.758934 -1.085057 -1.125412
C -0.154108 -0.792618 1.019967
C 1.696757 0.645168 0.167839
C 3.997169 0.785411 -0.619329
C 4.032048 -0.375754 -1.589268
H -2.773397 1.278633 1.176009
H -1.268114 2.926382 1.686239
H -0.225893 2.580948 0.302158
H -1.077961 1.166030 -1.430213
H -2.323507 2.375506 -1.079136
H 1.064292 2.193985 2.353995
H -0.188860 1.140037 3.029874
H -3.413977 -1.137786 0.968391
H -2.135508 -2.330616 0.567036
H -3.216122 0.516884 -2.523292
H -4.097491 0.627387 -0.994730
H 1.620190 -0.272251 2.120762
H -3.574284 -1.756180 -1.452227
H -1.864258 -1.384949 -1.708369
H 3.721079 1.738987 -1.102197
H 4.926793 0.892796 -0.030978
H 4.864120 -0.286587 -2.296801
H 4.139075 -1.335267 -1.064123
H 3.102258 -0.435936 -2.175138


%chk=000231312-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231312

0 1
O 0.181925 -2.054136 0.787243
O 3.205554 0.492729 0.542650
O 1.520520 0.865521 -1.027734
N -1.379756 -0.339032 0.536188
C -1.832688 1.084380 0.564994
C -0.700963 2.078421 0.904299
C -2.497108 1.447220 -0.789543
C 0.309275 1.483845 1.899099
C -2.445137 -1.315847 0.196349
C -3.630446 0.467582 -1.165953
C 0.946856 0.201289 1.298533
C -3.100165 -0.984185 -1.160050
C -0.117158 -0.817843 0.842806
C 1.873948 0.544167 0.132544
C 4.239492 0.792063 -0.500292
C 4.583482 -0.474412 -1.288333
H -2.614287 1.143526 1.357989
H -1.160521 2.995212 1.317211
H -0.176319 2.363083 -0.025652
H -1.711064 1.428216 -1.569694
H -2.879375 2.484858 -0.726272
H 1.095133 2.219198 2.152094
H -0.195828 1.207583 2.844984
H -3.215640 -1.287834 0.997019
H -1.980154 -2.314616 0.194661
H -4.046325 0.726691 -2.157635
H -4.460713 0.559193 -0.434539
H 1.557859 -0.314519 2.056954
H -3.920359 -1.702799 -1.349290
H -2.351284 -1.114388 -1.964640
H 3.850956 1.586140 -1.162193
H 5.095096 1.165061 0.085031
H 5.401832 -0.259806 -2.000608
H 4.913872 -1.280959 -0.611861
H 3.710186 -0.827703 -1.861461


