%chk=000276155.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276155

0 1
O -0.884653 -2.822306 0.885434
O -7.128817 -0.078853 1.342171
O -7.756059 0.421427 -0.891720
O 5.313979 -1.926801 -1.096522
O 4.288949 2.450508 0.968279
O 6.315773 0.454666 0.324348
C -1.542487 -0.700145 -0.016997
C -0.016246 -0.641608 0.274031
C -2.026679 -1.945056 0.751566
C 0.333709 -2.039243 0.826825
C -2.267069 0.584026 0.412980
C 0.791656 -0.282974 -0.983285
C -3.719655 0.554395 0.020933
C 2.247735 -0.081322 -0.660161
C -4.688540 0.222050 1.006140
C -4.093718 0.848232 -1.292235
C 2.661785 1.102728 -0.029553
C 3.182912 -1.059522 -1.001112
C -5.998864 0.209180 0.589197
C -5.443489 0.832514 -1.714313
C 4.543911 -0.877978 -0.678242
C 4.013524 1.284130 0.282668
C -6.374543 0.509976 -0.754224
C 4.972584 0.285563 -0.004148
C -8.268715 0.044848 0.427270
C 6.754436 -1.850301 -0.931018
C 5.435345 3.217679 0.508806
C 6.565630 0.269580 1.749543
H -1.711557 -0.862456 -1.108046
H 0.192022 0.122285 1.060545
H -2.770805 -2.546564 0.207081
H -2.392421 -1.716718 1.765460
H 1.005648 -2.627649 0.181049
H 0.736600 -2.001284 1.851242
H -2.159006 0.738039 1.506811
H -1.768356 1.462939 -0.048053
H 0.663625 -1.070941 -1.755144
H 0.379399 0.640886 -1.441419
H -4.407954 -0.007566 2.029359
H -3.330456 1.099700 -2.027738
H 1.952806 1.887481 0.220384
H 2.890318 -1.972968 -1.515201
H -5.721719 1.062897 -2.738479
H -8.736829 -0.944237 0.338659
H -8.902832 0.864168 0.790174
H 7.092947 -2.699354 -1.535932
H 7.005444 -1.976742 0.125091
H 7.138486 -0.897260 -1.312142
H 6.324185 2.587030 0.390009
H 5.560187 3.948708 1.314653
H 5.168067 3.702791 -0.434436
H 5.991547 1.001363 2.327689
H 6.307669 -0.750197 2.044953
H 7.641691 0.452155 1.823069


%chk=000276155-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276155

0 1
O -0.935855 -2.611696 1.563625
O -7.240739 0.504655 1.200768
O -7.869785 0.223761 -1.098262
O 5.469110 -1.856695 -1.176741
O 4.496078 2.191055 1.517079
O 6.431957 0.284067 0.535292
C -1.560148 -0.734806 0.165548
C -0.030508 -0.640094 0.445764
C -2.039763 -1.657477 1.306750
C 0.309183 -2.056504 0.969340
C -2.278148 0.638116 0.120208
C 0.809729 -0.215768 -0.784896
C -3.754650 0.537327 -0.246106
C 2.294276 -0.059205 -0.477150
C -4.753914 0.583773 0.771649
C -4.140978 0.372293 -1.601766
C 2.746869 1.009821 0.336690
C 3.243192 -0.967734 -0.998752
C -6.086348 0.451147 0.376566
C -5.502014 0.245185 -1.993250
C 4.619152 -0.847809 -0.688705
C 4.114848 1.144837 0.645482
C -6.456060 0.284877 -0.974382
C 5.064862 0.198338 0.165181
C -8.374669 0.167130 0.299069
C 6.692767 -1.424197 -1.888174
C 5.481085 3.150903 0.966483
C 6.678856 -0.115277 1.943644
H -1.709250 -1.254723 -0.803418
H 0.127593 0.095573 1.261541
H -2.938751 -2.245854 1.058162
H -2.238037 -1.066712 2.228128
H 0.624872 -2.723926 0.141155
H 1.095244 -2.056901 1.744549
H -2.163607 1.126794 1.108111
H -1.761003 1.283422 -0.617029
H 0.668780 -0.967498 -1.585992
H 0.410363 0.743959 -1.170343
H -4.487734 0.722072 1.823687
H -3.366049 0.347207 -2.376855
H 2.051899 1.755619 0.737511
H 2.937613 -1.794525 -1.648287
H -5.791417 0.128631 -3.040679
H -8.714861 -0.862640 0.518903
H -9.168308 0.919737 0.424560
H 7.213114 -2.357560 -2.151915
H 7.323352 -0.792759 -1.241206
H 6.420025 -0.873698 -2.809377
H 6.413985 2.636896 0.675640
H 5.670131 3.869453 1.778586
H 5.050320 3.675949 0.092574
H 6.112703 0.537369 2.632701
H 6.390186 -1.171784 2.093779
H 7.761552 0.007773 2.100861


