%chk=000256422.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256422

0 1
O 0.097370 0.183743 0.015620
O -4.453071 -1.662066 -0.547715
O -0.924580 2.573240 -0.157430
O -5.399364 0.731044 -0.444800
O 6.303033 -0.325584 -0.258854
O -3.595109 2.987481 -0.052933
O -1.974942 -3.294007 0.373099
C -2.086310 -0.960136 -0.123704
C -1.285450 0.208159 -0.060816
C -3.473463 -0.760438 -0.308875
C -1.801853 1.508556 -0.075424
C 0.749310 -1.051668 -0.033341
C -4.037099 0.553463 -0.244344
C -3.215672 1.686135 -0.120552
C -1.403784 -2.253583 0.094916
C 2.192482 -0.822191 -0.095833
C 0.060515 -2.206932 -0.003607
C 3.088842 -1.827431 0.331013
C 2.695944 0.398946 -0.580819
C 4.943097 -0.388957 -0.230462
C 6.978409 0.919546 -0.682025
C 4.457101 -1.621844 0.267121
C 4.068548 0.625452 -0.654214
C 6.957793 1.892966 0.484281
C 8.367658 0.410956 -1.032116
C -4.164442 -3.020130 -0.978077
C -0.868563 3.373227 1.057971
C -6.228888 0.176829 0.616382
C -5.008505 3.312407 -0.187505
H 0.552928 -3.178559 -0.032292
H 2.699148 -2.771524 0.719176
H 1.995048 1.178473 -0.902235
H 6.445887 1.317186 -1.572937
H 5.167072 -2.381129 0.589085
H 4.442110 1.569356 -1.038943
H 7.537984 2.796790 0.266428
H 5.937542 2.204249 0.742264
H 7.383637 1.438878 1.390216
H 9.033785 1.230303 -1.323165
H 8.330630 -0.311441 -1.858672
H 8.828502 -0.112183 -0.182060
H -5.116588 -3.301181 -1.443332
H -3.937967 -3.632074 -0.091464
H -3.340666 -3.045225 -1.694202
H -0.532077 2.761076 1.896999
H -1.848799 3.822490 1.248503
H -0.126869 4.133020 0.791120
H -6.139513 -0.916420 0.618670
H -7.230726 0.488195 0.304654
H -5.950847 0.600018 1.582672
H -5.551371 2.958364 0.692155
H -5.416439 2.868119 -1.104035
H -4.973517 4.406336 -0.242661


%chk=000256422-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256422

0 1
O 0.068743 0.166563 -0.133868
O -4.438405 -1.937965 0.153031
O -1.061963 2.583126 -0.260621
O -5.520336 0.595618 0.109040
O 6.431926 -0.372049 -0.378847
O -3.856789 2.883630 0.041552
O -1.961733 -3.466057 0.104228
C -2.110452 -1.020022 -0.029417
C -1.333561 0.177484 -0.084112
C -3.536638 -0.873681 0.030754
C -1.905800 1.476255 -0.093376
C 0.766258 -1.046629 -0.092253
C -4.124466 0.419401 0.069372
C -3.316027 1.591314 -0.013215
C -1.384008 -2.325494 0.031202
C 2.222407 -0.847171 -0.160642
C 0.074614 -2.234803 -0.000565
C 3.126595 -1.943092 -0.044563
C 2.763309 0.453486 -0.348737
C 5.039986 -0.438811 -0.304495
C 7.106968 0.952872 -0.535072
C 4.511128 -1.744459 -0.114482
C 4.153626 0.664773 -0.419547
C 7.138931 1.690121 0.814887
C 8.502297 0.619689 -1.070958
C -4.598598 -2.839114 -1.012829
C -1.041859 3.552294 0.860666
C -6.186745 0.128179 1.349329
C -4.818202 3.241780 -1.031072
H 0.610371 -3.185210 0.035119
H 2.748134 -2.958997 0.106101
H 2.078489 1.301321 -0.442252
H 6.547199 1.540777 -1.291232
H 5.210127 -2.581407 -0.027176
H 4.528101 1.681429 -0.567411
H 7.635016 2.671303 0.699896
H 6.125341 1.861721 1.215757
H 7.706419 1.097971 1.554059
H 9.081427 1.547088 -1.230107
H 8.433138 0.077913 -2.029302
H 9.047033 -0.015643 -0.350931
H -5.477658 -3.455799 -0.770456
H -3.702192 -3.471808 -1.113396
H -4.791700 -2.245087 -1.925853
H -0.659836 3.064903 1.777985
H -2.050236 3.964539 1.032477
H -0.349252 4.345308 0.540254
H -6.018192 -0.952568 1.485168
H -7.256363 0.339637 1.198438
H -5.806780 0.696896 2.218848
H -5.676830 2.551393 -1.021130
H -4.307631 3.219220 -2.011766
H -5.137429 4.268162 -0.795580


