%chk=000222596.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222596

0 1
O -1.241358 -0.029966 1.519423
O 0.678235 -0.161455 2.675366
C 0.744276 -0.038498 0.147089
C 1.528126 -1.285068 -0.230876
C 1.615271 1.202437 0.041306
C -0.537904 0.019954 -0.661654
C 0.182051 -0.090158 1.593497
C -1.612517 0.016572 0.151869
C 2.136650 -1.327423 -1.496916
C 2.833433 1.232725 0.741335
C 1.644879 -2.382669 0.630607
C 1.228944 2.307504 -0.726855
C -3.054295 0.053045 -0.067930
C 2.848985 -2.459903 -1.894551
C 3.657726 2.356189 0.663255
C 2.360597 -3.514995 0.226170
C 2.060084 3.430514 -0.802622
C 2.961441 -3.557929 -1.034156
C 3.273804 3.456995 -0.111177
C -3.571706 -0.076110 -1.368745
C -3.929469 0.218277 1.020469
C -4.952612 -0.035124 -1.574022
C -5.308209 0.258082 0.805765
C -5.820843 0.132402 -0.489932
H -0.515450 0.032481 -1.734829
H 2.059052 -0.470419 -2.165499
H 3.130497 0.378262 1.352624
H 1.192020 -2.371221 1.622798
H 0.281059 2.306375 -1.263775
H 3.319625 -2.487559 -2.876206
H 4.600210 2.375641 1.208905
H 2.447812 -4.365413 0.901573
H 1.755470 4.287539 -1.401295
H 3.516606 -4.440602 -1.345736
H 3.918131 4.332287 -0.171086
H -2.899968 -0.211777 -2.215414
H -3.519993 0.312585 2.030136
H -5.353635 -0.135379 -2.581700
H -5.984758 0.386577 1.650002
H -6.897266 0.163829 -0.654715


%chk=000222596-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222596

0 1
O -1.217445 0.035526 1.553026
O 0.805090 -0.089950 2.696242
C 0.769854 -0.019111 0.159712
C 1.546249 -1.316138 -0.176673
C 1.654905 1.245794 0.018120
C -0.513342 0.031925 -0.655200
C 0.211374 -0.036186 1.614946
C -1.604198 0.043983 0.159942
C 2.180045 -1.405051 -1.443931
C 2.988025 1.226712 0.500547
C 1.605461 -2.427211 0.698170
C 1.136417 2.444114 -0.529931
C -3.049299 0.060402 -0.087990
C 2.852691 -2.582123 -1.831247
C 3.792115 2.383193 0.420243
C 2.281233 -3.607542 0.309282
C 1.944175 3.600936 -0.614538
C 2.904575 -3.692129 -0.954783
C 3.274830 3.574701 -0.140659
C -3.555093 0.010435 -1.417085
C -3.963301 0.126362 0.999131
C -4.943498 0.029004 -1.651188
C -5.353350 0.144326 0.758186
C -5.849848 0.096412 -0.564633
H -0.525747 0.020415 -1.743864
H 2.158944 -0.542566 -2.120946
H 3.391620 0.308524 0.940155
H 1.145783 -2.377497 1.690276
H 0.100999 2.474006 -0.887543
H 3.338878 -2.632846 -2.811946
H 4.820252 2.356381 0.797933
H 2.322138 -4.457666 0.999301
H 1.532517 4.520830 -1.044856
H 3.427747 -4.607396 -1.252990
H 3.900713 4.471878 -0.203693
H -2.863023 -0.048804 -2.264543
H -3.573090 0.162392 2.020299
H -5.322012 -0.011931 -2.678374
H -6.048821 0.195001 1.602967
H -6.929559 0.109502 -0.749367


