%chk=000240481.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240481

0 1
O -1.903001 2.357251 1.295636
O -1.578449 -1.246537 -2.084884
O 2.224632 0.106463 -1.852956
O -5.106583 -0.914832 1.037525
O 4.399137 -0.814458 -0.315147
O 0.114850 1.905375 -1.595007
C -1.478440 0.601727 -0.417752
C 0.990339 0.474749 0.091654
C -0.106215 1.070251 -0.744913
C -2.245105 1.228022 0.596118
C -2.060823 -0.528842 -1.029782
C 2.200706 0.056715 -0.483142
C -3.451559 0.701451 1.068117
C -3.271417 -1.095682 -0.581661
C -3.936019 -0.479381 0.479716
C 0.819163 0.364245 1.486216
C 3.246523 -0.438757 0.356604
C 1.839727 -0.117740 2.293239
C 3.064561 -0.518075 1.732179
C -0.998152 3.333892 0.723050
C -0.508967 -0.730926 -2.915248
C 3.501258 -0.011890 -2.534362
C -5.714100 -2.116904 0.497118
C 5.524143 -1.247695 0.487853
H -4.004283 1.198810 1.860490
H -3.648524 -1.979597 -1.082383
H -0.130654 0.667681 1.935537
H 1.697305 -0.192808 3.370306
H 3.849795 -0.893193 2.383841
H -1.254934 4.237180 1.291566
H -1.187375 3.477753 -0.347517
H 0.035220 3.030199 0.916776
H -0.686845 0.315837 -3.187565
H -0.575888 -1.383951 -3.793975
H 0.452729 -0.863916 -2.402808
H 3.876816 -1.036624 -2.432742
H 4.215700 0.714522 -2.135716
H 3.221678 0.224697 -3.567688
H -5.988080 -1.962555 -0.550684
H -6.605495 -2.219540 1.129247
H -5.040276 -2.969668 0.621529
H 5.270883 -2.159883 1.035965
H 5.849957 -0.445207 1.155669
H 6.279661 -1.450058 -0.282218


%chk=000240481-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240481

0 1
O -1.748175 2.846954 0.864807
O -0.991832 -1.696307 -0.957049
O 2.538533 0.222223 -1.777334
O -5.345481 -0.303298 0.726796
O 4.640075 -1.057195 -0.551706
O 0.494335 2.075737 -0.897438
C -1.279708 0.629214 -0.114265
C 1.209722 0.083713 0.262639
C 0.161839 0.996028 -0.318337
C -2.199889 1.580527 0.437577
C -1.790248 -0.668039 -0.415499
C 2.429098 -0.146468 -0.427020
C -3.536560 1.240824 0.707382
C -3.134245 -1.019418 -0.159172
C -4.003012 -0.063468 0.415914
C 1.017940 -0.465213 1.558718
C 3.473938 -0.882998 0.209006
C 2.052949 -1.186005 2.180221
C 3.284554 -1.391642 1.515502
C -1.848975 3.929995 -0.139393
C -0.394016 -1.456876 -2.291591
C 3.441386 1.356468 -2.074116
C -5.874957 -1.645276 0.461754
C 5.709039 -1.873169 0.029835
H -4.203710 1.968954 1.175277
H -3.454302 -2.029331 -0.425617
H 0.068046 -0.297283 2.075469
H 1.910229 -1.591801 3.187200
H 4.077549 -1.958291 2.013079
H -2.896441 4.043490 -0.482517
H -1.176668 3.713831 -0.987672
H -1.524852 4.841673 0.385379
H -1.193936 -1.266131 -3.032896
H 0.133216 -2.391588 -2.535381
H 0.331132 -0.624835 -2.288538
H 4.460548 1.146705 -1.704009
H 3.026325 2.274467 -1.621506
H 3.447307 1.442050 -3.171410
H -5.828912 -1.887970 -0.617329
H -6.923681 -1.608956 0.790365
H -5.326443 -2.413466 1.039674
H 5.356778 -2.900342 0.245771
H 6.110885 -1.415462 0.954887
H 6.494217 -1.903922 -0.739654


