%chk=000230998.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230998

0 1
O -4.350748 1.126404 1.267649
C 2.472659 -1.677701 0.320438
C 2.726542 -0.327355 -0.362225
C 1.098718 -2.264811 -0.040885
C 4.106022 0.235894 0.002551
C -0.039121 -1.477025 0.564163
C 4.357304 1.589342 -0.677300
C -0.730259 -0.591413 -0.169954
C -1.861753 0.249229 0.335292
C -0.315996 -1.764653 2.006101
C 5.728958 2.156571 -0.318126
C -3.141743 0.004603 -0.475565
C -4.340851 0.694290 0.137333
C -5.546138 0.801748 -0.758406
H 2.554591 -1.564735 1.419020
H 3.261419 -2.398863 0.030572
H 1.933933 0.390595 -0.070315
H 2.640719 -0.437600 -1.459845
H 0.994992 -2.317681 -1.143328
H 1.048923 -3.317196 0.305265
H 4.189993 0.348120 1.100626
H 4.897371 -0.481448 -0.287355
H 3.567314 2.308768 -0.384901
H 4.274307 1.479715 -1.776207
H -0.482024 -0.424034 -1.217715
H -1.580845 1.322141 0.285648
H -2.067262 0.055633 1.413851
H -1.139963 -1.151383 2.404485
H -0.592470 -2.815829 2.158558
H 0.567336 -1.562253 2.626921
H 6.537437 1.484826 -0.627822
H 5.829954 2.314215 0.761720
H 5.898611 3.122062 -0.807520
H -3.344637 -1.086486 -0.529383
H -2.998533 0.325779 -1.525205
H -5.785323 -0.142653 -1.259356
H -6.434849 1.109304 -0.186753
H -5.393286 1.558980 -1.538526


%chk=000230998-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230998

0 1
O -4.519072 1.687722 0.853521
C 2.472186 -1.676255 0.096109
C 2.857248 -0.244483 -0.338265
C 1.016138 -2.073433 -0.280718
C 4.307911 0.132289 0.038089
C -0.068623 -1.243571 0.403441
C 4.704356 1.558950 -0.407255
C -0.948061 -0.508465 -0.338791
C -2.089868 0.359477 0.148510
C -0.086176 -1.319675 1.921170
C 6.151973 1.931011 -0.019600
C -3.456835 -0.139288 -0.376871
C -4.643271 0.734256 0.039306
C -5.991047 0.399498 -0.595877
H 2.618697 -1.782039 1.190298
H 3.167121 -2.399644 -0.377747
H 2.155217 0.482623 0.117808
H 2.725840 -0.150182 -1.436952
H 0.899769 -1.998845 -1.380168
H 0.871418 -3.142522 -0.013729
H 4.436466 0.044469 1.137688
H 5.009565 -0.599791 -0.414939
H 3.999919 2.288634 0.041767
H 4.580287 1.644310 -1.506234
H -0.829030 -0.539192 -1.434910
H -1.947036 1.402975 -0.197490
H -2.127403 0.416085 1.249452
H -0.982597 -0.855686 2.363302
H -0.044362 -2.374655 2.256535
H 0.798018 -0.814373 2.357090
H 6.877077 1.233082 -0.479680
H 6.292347 1.883813 1.076995
H 6.411132 2.953919 -0.349729
H -3.650184 -1.171578 -0.015544
H -3.451534 -0.220264 -1.484412
H -6.136678 -0.691305 -0.693339
H -6.811134 0.840718 -0.007728
H -6.028469 0.826519 -1.617601


