%chk=000271759.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271759

0 1
O -2.710142 -0.169645 -0.001127
O 3.349523 -1.765981 -0.000058
O -1.887299 1.931286 0.000536
O 3.281039 2.221692 -0.000721
C -0.372994 0.042669 -0.000162
C 0.799154 0.815233 -0.000243
C 2.056095 0.197632 -0.000204
C -0.298130 -1.363886 -0.000031
C 2.101512 -1.212550 -0.000067
C 0.937784 -2.002383 0.000029
C -1.673955 0.739283 -0.000208
C -4.071608 0.390427 -0.001163
C -4.964614 -0.830846 -0.002313
C 3.300614 1.010544 -0.000313
H 0.740339 1.915175 -0.000368
H -1.225189 -1.949326 -0.000006
H 0.998660 -3.086564 0.000123
H -4.174953 1.015471 0.902731
H -4.174380 1.016748 -0.904241
H -6.023939 -0.545648 -0.002498
H -4.784479 -1.460037 -0.884688
H -4.785111 -1.461248 0.879322
H 4.239846 0.433801 0.000008
H 3.330127 -2.759345 0.000064


%chk=000271759-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271759

0 1
O -2.744193 -0.227381 -0.000437
O 3.471312 -1.783833 -0.000345
O -1.856930 1.931196 0.000028
O 3.286761 2.308666 -0.000499
C -0.359672 0.002666 0.000213
C 0.811235 0.792222 -0.000157
C 2.095706 0.198444 -0.000358
C -0.244245 -1.414992 0.000365
C 2.190390 -1.225111 -0.000158
C 1.020946 -2.026015 0.000203
C -1.683484 0.687889 0.000461
C -4.113676 0.370705 -0.001061
C -5.103418 -0.790169 -0.002650
C 3.317247 1.047517 -0.000784
H 0.737632 1.885440 -0.000283
H -1.153296 -2.022154 0.000632
H 1.102879 -3.120623 0.000354
H -4.212707 1.012154 0.893335
H -4.211355 1.013438 -0.894683
H -6.136720 -0.398011 -0.003171
H -4.971497 -1.420406 -0.898849
H -4.972898 -1.421702 0.892844
H 4.283308 0.495077 -0.000421
H 3.434576 -2.772512 -0.000178


