%chk=000240479.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240479

0 1
O -0.982156 -2.359000 0.671100
O -1.694363 2.016760 -1.437071
O -5.036428 -0.086985 1.164713
O 0.524178 -0.884504 -1.933698
O 5.031581 0.675005 0.146630
O 3.029381 -0.449584 -1.585746
C -1.174659 -0.202168 -0.439438
C 1.300572 0.221595 -0.013148
C 0.234522 -0.329139 -0.871395
C -1.748126 -1.254421 0.322101
C -1.997323 0.907731 -0.703258
C -3.029649 -1.198069 0.846540
C -3.308116 1.008493 -0.185963
C -3.799318 -0.039517 0.590359
C 2.646372 0.125271 -0.419226
C 0.998942 0.831823 1.227177
C 3.680466 0.658105 0.412665
C 2.005719 1.343524 2.027955
C 3.351254 1.259180 1.625989
C -0.782419 -3.328390 -0.393381
C -0.446715 2.103827 -2.168744
C -5.929944 1.039873 0.963030
C 5.510122 -0.066072 -1.004561
H -3.433245 -2.012960 1.442571
H -3.888933 1.895537 -0.416242
H -0.043335 0.889171 1.549301
H 1.767466 1.811623 2.982138
H 4.148170 1.658082 2.255345
H -0.055580 -4.014254 0.058238
H -0.376690 -2.852227 -1.294084
H -1.732375 -3.830534 -0.598155
H -0.332363 1.247777 -2.843539
H 0.389647 2.206814 -1.469629
H -0.591670 3.031764 -2.739117
H 2.220683 -0.850438 -2.106266
H -5.494122 1.948576 1.388460
H -6.816594 0.723279 1.528300
H -6.159505 1.154126 -0.100438
H 5.116335 0.378384 -1.924991
H 5.224889 -1.119398 -0.925765
H 6.594228 0.069242 -0.918959


%chk=000240479-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240479

0 1
O -0.505512 -1.836501 0.486779
O -2.003100 2.360178 -1.577392
O -5.157675 -0.525535 0.623104
O 0.466604 0.261485 -2.327576
O 5.220550 0.369313 -0.267373
O 2.946282 0.204833 -2.054389
C -1.134386 0.230451 -0.531987
C 1.426236 0.378609 -0.132572
C 0.273532 0.290370 -1.039716
C -1.538794 -0.928972 0.218871
C -2.159575 1.152220 -0.894270
C -2.871565 -1.156837 0.592564
C -3.514336 0.933862 -0.524512
C -3.858542 -0.212593 0.209321
C 2.754679 0.309956 -0.693534
C 1.264455 0.585462 1.269394
C 3.890766 0.380744 0.174707
C 2.384496 0.698819 2.102412
C 3.689163 0.582279 1.554100
C -0.840857 -3.069886 1.202327
C -0.689237 2.962702 -1.838063
C -6.230948 0.399144 0.243167
C 5.619718 -0.621143 -1.292208
H -3.186954 -2.044609 1.143442
H -4.240207 1.695154 -0.816351
H 0.251844 0.659369 1.677259
H 2.262486 0.868723 3.176636
H 4.579356 0.658861 2.186908
H 0.111532 -3.612016 1.291956
H -1.567822 -3.676920 0.629589
H -1.246028 -2.853353 2.209326
H -0.192508 2.465899 -2.687573
H -0.040734 2.912824 -0.942970
H -0.910722 4.013728 -2.077512
H 1.990124 0.214330 -2.480928
H -6.066560 1.402640 0.680426
H -7.149154 -0.042361 0.656808
H -6.315628 0.482032 -0.857184
H 5.071111 -0.459513 -2.232452
H 5.439468 -1.648840 -0.921655
H 6.699342 -0.457005 -1.429079


