%chk=000242697.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242697

0 1
O -2.381177 0.321005 1.659781
O -4.347332 -0.974789 0.420225
O -3.935320 -2.697992 -0.973836
O -1.123345 2.620070 -1.594549
O -2.457510 3.144437 0.156274
O 5.328118 -1.378153 -0.923281
C -2.040133 -1.546768 0.122102
C -1.777347 -0.024407 0.414054
C -1.165629 -1.968119 -1.075684
C -0.292503 0.244362 0.600114
C 0.327955 -1.750543 -0.819073
C 0.670533 -0.528785 -0.011037
C -2.364082 0.850977 -0.725518
C -1.750122 -2.377448 1.375932
C -3.498894 -1.844988 -0.242479
C 2.067933 -0.191445 0.160992
C 0.069737 1.351520 1.431552
C 2.415177 0.917935 0.978844
C 1.383427 1.677899 1.618160
C -2.026075 2.308293 -0.598617
C 3.109080 -0.935541 -0.460519
C 3.790519 1.261588 1.159834
C 4.429033 -0.568639 -0.259263
C 4.791943 0.540060 0.557720
C -5.776826 -1.179234 0.263190
C -0.625696 3.983660 -1.631015
C 6.738837 -1.089581 -0.782531
H -1.476170 -1.404624 -1.980450
H -1.352628 -3.035640 -1.318015
H 0.853500 -1.708817 -1.799092
H 0.744467 -2.640027 -0.293271
H -3.474249 0.755327 -0.740387
H -1.999177 0.468782 -1.708143
H -0.696477 -2.282971 1.676137
H -2.341785 -2.019139 2.232549
H -1.956809 -3.442238 1.225488
H -0.736104 1.911886 1.919106
H -3.369796 0.301693 1.600065
H 1.666119 2.514798 2.254859
H 2.887200 -1.788940 -1.096627
H 4.033661 2.116713 1.792479
H 5.834406 0.805956 0.699442
H -6.012226 -1.487734 -0.761985
H -6.197845 -0.197700 0.503993
H -6.088004 -1.945246 0.980218
H -1.439801 4.695631 -1.458085
H -0.214327 4.067182 -2.641913
H 0.150745 4.084476 -0.866143
H 7.189471 -1.876071 -1.402810
H 7.047174 -1.192188 0.261646
H 6.967552 -0.098182 -1.183331


%chk=000242697-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242697

0 1
O -2.421155 0.481113 1.599531
O -4.418488 -1.167091 0.664809
O -3.963293 -2.435731 -1.225328
O -1.043689 2.731659 -1.546470
O -2.769291 3.179711 -0.044015
O 5.413521 -1.535173 -0.850348
C -2.065072 -1.511931 0.106967
C -1.793139 0.032841 0.353877
C -1.179341 -2.006018 -1.066077
C -0.288028 0.293884 0.522756
C 0.326752 -1.812444 -0.795066
C 0.688657 -0.531417 -0.054770
C -2.379606 0.871402 -0.851697
C -1.767346 -2.320747 1.406357
C -3.535612 -1.767109 -0.261318
C 2.090539 -0.198223 0.115768
C 0.089716 1.449108 1.288875
C 2.458466 0.982277 0.872942
C 1.426668 1.786861 1.457097
C -2.123883 2.361389 -0.736503
C 3.135446 -1.003882 -0.433841
C 3.842209 1.302545 1.033632
C 4.483537 -0.662035 -0.257481
C 4.849544 0.506582 0.483483
C -5.867406 -1.395515 0.426569
C -0.630620 4.151010 -1.459109
C 6.836638 -1.226323 -0.698534
H -1.469153 -1.480987 -1.993488
H -1.392377 -3.073767 -1.251991
H 0.861672 -1.853357 -1.763602
H 0.713954 -2.671137 -0.207844
H -3.474924 0.725499 -0.872733
H -1.945160 0.517180 -1.798984
H -0.724447 -2.155132 1.723298
H -2.420914 -2.001710 2.232673
H -1.914478 -3.400802 1.223681
H -0.704417 2.034289 1.760031
H -3.386587 0.240500 1.547015
H 1.706917 2.665047 2.051101
H 2.915933 -1.908596 -1.006249
H 4.110650 2.196944 1.608582
H 5.899634 0.778639 0.624587
H -6.161017 -0.992081 -0.556642
H -6.374248 -0.863126 1.243314
H -6.084498 -2.475541 0.457717
H -1.500955 4.815816 -1.590232
H 0.102420 4.282614 -2.267188
H -0.168906 4.341313 -0.475182
H 7.361548 -2.030994 -1.234304
H 7.141678 -1.229359 0.366220
H 7.091148 -0.249696 -1.154781


