%chk=000221752.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221752

0 1
O 3.003128 -0.201088 0.527233
O 4.069445 1.125364 -0.958400
C -1.190498 0.002251 0.244170
C -2.665634 0.060087 -0.234386
C -0.480637 -1.260688 -0.291402
C -0.407439 1.253200 -0.210856
C -3.449336 -1.190079 0.221362
C -3.376025 1.322737 0.300130
C 0.971047 -1.337359 0.193030
C 1.045906 1.212449 0.272480
C 1.728948 -0.069868 -0.207624
C -4.905740 -1.139618 -0.260266
C -4.832072 1.387353 -0.180805
C -5.612039 0.131344 0.230953
C 4.110096 0.455344 0.046643
C 5.264782 0.190259 0.976976
C 6.539985 -0.078815 0.190230
H -1.180460 -0.033835 1.360070
H -2.675980 0.095561 -1.350206
H -0.511446 -1.269224 -1.397839
H -1.023276 -2.169773 0.033540
H -0.895868 2.169995 0.172903
H -0.435765 1.335879 -1.314482
H -3.422631 -1.267132 1.324678
H -2.964013 -2.107402 -0.161979
H -2.837414 2.232401 -0.026429
H -3.346487 1.329414 1.406015
H 1.009700 -1.459692 1.294266
H 1.475281 -2.229782 -0.222250
H 1.602006 2.095546 -0.099257
H 1.089701 1.268079 1.377555
H 1.963855 -0.035002 -1.292670
H -5.449375 -2.034526 0.095173
H -4.936703 -1.181111 -1.365933
H -4.858669 1.500165 -1.281611
H -5.323251 2.288337 0.231214
H -6.639999 0.174035 -0.173326
H -5.715532 0.099753 1.332422
H 5.390438 1.075491 1.638348
H 5.028327 -0.660056 1.653507
H 6.742331 0.726396 -0.532013
H 7.407446 -0.154373 0.856292
H 6.476468 -1.014517 -0.379556


%chk=000221752-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221752

0 1
O 3.100781 -0.397101 0.645545
O 4.033437 0.871480 -1.080730
C -1.244007 -0.047692 0.366867
C -2.689536 0.050621 -0.222087
C -0.533367 -1.368350 -0.045354
C -0.360076 1.162379 -0.049550
C -3.574915 -1.163355 0.180765
C -3.402210 1.368696 0.194818
C 0.918673 -1.465858 0.484992
C 1.089103 1.061655 0.485057
C 1.736606 -0.254474 0.029383
C -5.018386 -1.060067 -0.366971
C -4.845683 1.470707 -0.352952
C -5.701047 0.255484 0.069156
C 4.162157 0.235469 -0.008203
C 5.454159 0.043757 0.773548
C 6.707192 0.392583 -0.050463
H -1.331099 -0.039931 1.477772
H -2.599226 0.050139 -1.333180
H -0.528360 -1.438781 -1.154256
H -1.097203 -2.243036 0.325103
H -0.798818 2.108543 0.314720
H -0.341427 1.226843 -1.158423
H -3.608344 -1.225490 1.290074
H -3.124272 -2.107256 -0.178533
H -2.825845 2.245807 -0.153122
H -3.428462 1.421618 1.304860
H 0.913947 -1.496121 1.592457
H 1.396362 -2.399244 0.133258
H 1.688152 1.919905 0.130057
H 1.082804 1.087529 1.593108
H 1.867180 -0.246360 -1.070606
H -5.610826 -1.933366 -0.030083
H -4.990052 -1.102352 -1.476019
H -4.811094 1.521587 -1.461374
H -5.313250 2.412606 -0.004918
H -6.716893 0.326892 -0.366152
H -5.822170 0.257624 1.172581
H 5.391045 0.686168 1.674760
H 5.484170 -0.995710 1.147407
H 6.644174 1.421654 -0.442601
H 7.614508 0.306395 0.573141
H 6.814716 -0.284099 -0.915953


