%chk=000226025.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226025

0 1
O -3.321270 0.056326 1.870209
O -5.087488 -0.131955 -1.057389
O -5.744968 2.399867 -0.344803
O 6.604796 0.506843 0.484486
C -1.888754 0.064319 -0.159634
C -0.983933 -1.127921 0.294822
C 0.395143 -1.024763 -0.369531
C 1.060935 0.284240 0.152065
C -3.253616 -0.355459 0.494905
C -1.265058 1.365250 0.365653
C -1.858721 -2.370422 0.056691
C 0.179116 1.513456 -0.146647
C 2.510765 0.422769 -0.412016
C -3.293488 -1.899362 0.382492
C -2.081742 0.139883 -1.678898
C 1.272782 -2.211863 -0.101395
C 3.313728 -0.820721 -0.014383
C 3.176753 1.678263 0.209799
C -4.479006 0.337396 -0.123690
C 2.521485 0.514993 -1.946272
C 2.601224 -2.105612 0.036203
C 4.670938 1.768149 -0.091841
C 4.627883 -0.759366 0.266933
C -4.899451 1.646839 0.519569
C 5.413502 0.491451 0.251314
H -0.822286 -1.045956 1.401421
H 0.264146 -0.951344 -1.483839
H 1.152232 0.192914 1.264799
H -1.288215 1.383154 1.472353
H -1.862115 2.240854 0.046569
H -1.556017 -3.217299 0.692152
H -1.785771 -2.722380 -0.986913
H 0.164332 1.709038 -1.237250
H 0.628212 2.415331 0.313160
H -4.002714 -2.211115 -0.409637
H -3.671224 -2.344458 1.318167
H -1.120447 0.115484 -2.207816
H -2.681808 -0.694551 -2.065677
H -2.590883 1.063978 -1.978491
H 0.769656 -3.177469 -0.051032
H 3.026705 1.668540 1.308334
H 2.673230 2.592630 -0.159207
H 3.543960 0.603071 -2.333665
H 2.081097 -0.376030 -2.408796
H 1.960512 1.386508 -2.300138
H 3.222539 -2.988379 0.205761
H -2.653100 -0.419838 2.406871
H 5.127651 2.618380 0.456028
H 4.846601 1.994607 -1.164654
H 5.208434 -1.644645 0.534493
H -4.043259 2.320163 0.725241
H -5.425846 1.450349 1.478333
H -6.335275 1.792365 -0.858406


%chk=000226025-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000226025

0 1
O -3.196062 -0.027785 1.963091
O -5.145000 0.068699 -0.998007
O -6.061811 2.314571 0.147131
O 6.641850 0.547499 0.863854
C -1.930374 0.083198 -0.240929
C -1.015242 -1.119230 0.175956
C 0.398081 -1.019287 -0.444645
C 1.058730 0.315402 0.029182
C -3.269071 -0.344032 0.519086
C -1.277947 1.406544 0.223578
C -1.894588 -2.367058 -0.080091
C 0.172129 1.540531 -0.321258
C 2.555277 0.425043 -0.448939
C -3.344064 -1.887120 0.271219
C -2.193894 0.123639 -1.770543
C 1.277664 -2.202537 -0.105435
C 3.316950 -0.792418 0.109791
C 3.199847 1.730707 0.105571
C -4.506566 0.413395 0.037964
C 2.661750 0.392662 -2.005552
C 2.612226 -2.075040 0.166371
C 4.734697 1.778216 -0.055964
C 4.635200 -0.713366 0.510846
C -4.973234 1.636901 0.819490
C 5.429163 0.524915 0.480938
H -0.854053 -1.043581 1.278879
H 0.277901 -0.993917 -1.550919
H 1.099575 0.256486 1.141751
H -1.262417 1.441582 1.330501
H -1.873580 2.276649 -0.115846
H -1.588477 -3.230805 0.535365
H -1.828074 -2.679778 -1.138661
H 0.144511 1.691886 -1.417491
H 0.615010 2.456470 0.110253
H -4.051608 -2.092824 -0.549729
H -3.742227 -2.373792 1.179033
H -1.251128 0.192388 -2.338103
H -2.744635 -0.759818 -2.132509
H -2.798375 1.009079 -2.034807
H 0.811465 -3.196579 -0.081230
H 2.949932 1.814820 1.183086
H 2.756883 2.609425 -0.399303
H 3.713352 0.484771 -2.327752
H 2.279065 -0.554840 -2.423248
H 2.094315 1.227218 -2.456054
H 3.202600 -2.959638 0.439882
H -2.423482 -0.505206 2.356690
H 5.165407 2.657306 0.455838
H 5.012353 1.879059 -1.124866
H 5.156621 -1.605630 0.882723
H -4.123390 2.333153 0.961108
H -5.277463 1.301773 1.831737
H -6.323888 1.746796 -0.632230


