%chk=000236079.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236079

0 1
O 0.018516 0.276316 0.536418
O -0.234125 -2.044016 0.490373
C 0.687020 -0.956258 0.258325
C 1.731434 -1.119726 1.370667
C 1.241707 -1.030709 -1.172507
C -1.220994 0.527667 -0.178091
C 3.540153 -0.438915 -0.278544
C -2.199839 -0.627871 0.136443
C 2.955103 -0.232820 1.133111
C 2.463555 -0.123182 -1.337600
C -1.500941 -1.959742 -0.184979
C -1.673950 1.881055 0.380743
C -3.510106 -0.484899 -0.652598
C 4.775514 0.443453 -0.485324
C -0.945939 3.048268 -0.297655
C -4.586525 -1.458806 -0.181841
C -1.369511 4.393482 0.286201
H 2.013918 -2.189170 1.433260
H 1.257345 -0.870049 2.342051
H 0.464802 -0.755168 -1.907786
H 1.507648 -2.084468 -1.388813
H -0.989802 0.575557 -1.263811
H 3.844628 -1.508677 -0.386472
H -2.414910 -0.607677 1.233992
H 3.722463 -0.444150 1.899821
H 2.667008 0.829507 1.268289
H 2.150495 0.936201 -1.247555
H 2.882273 -0.238759 -2.353497
H -2.043327 -2.827148 0.233625
H -1.342862 -2.106773 -1.266129
H -1.469978 1.899544 1.473014
H -2.769555 1.992014 0.270918
H -3.322640 -0.625828 -1.735086
H -3.886543 0.554971 -0.548535
H 4.535567 1.508296 -0.390372
H 5.553983 0.217711 0.251512
H 5.212359 0.293144 -1.478221
H -1.137128 3.035664 -1.387839
H 0.149040 2.910956 -0.175977
H -4.297091 -2.502240 -0.350131
H -4.792619 -1.347117 0.889547
H -5.529870 -1.292469 -0.714993
H -2.443685 4.569904 0.163012
H -1.148153 4.453767 1.358424
H -0.841840 5.220160 -0.202588


%chk=000236079-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000236079

0 1
O 0.044196 0.270531 0.581976
O -0.298643 -2.119297 0.672011
C 0.660042 -1.047269 0.349693
C 1.786320 -1.168754 1.384694
C 1.202403 -1.185714 -1.095718
C -1.232117 0.509756 -0.140392
C 3.498751 -0.329018 -0.336697
C -2.249710 -0.614413 0.199866
C 2.937135 -0.177705 1.100347
C 2.348205 -0.183486 -1.365700
C -1.580603 -1.988187 -0.042065
C -1.671804 1.920946 0.283597
C -3.555761 -0.483825 -0.628666
C 4.633802 0.679795 -0.610534
C -0.663065 3.023107 -0.111329
C -4.610318 -1.573673 -0.326884
C -1.130155 4.429479 0.320256
H 2.155301 -2.211516 1.354761
H 1.347961 -0.996083 2.383226
H 0.397261 -1.049789 -1.840944
H 1.571093 -2.224188 -1.206139
H -1.040700 0.500681 -1.239871
H 3.910474 -1.358418 -0.434278
H -2.489342 -0.533954 1.280110
H 3.747227 -0.330338 1.840119
H 2.564017 0.857014 1.234077
H 1.949581 0.849795 -1.309577
H 2.735927 -0.330072 -2.393267
H -2.194527 -2.810837 0.357189
H -1.442515 -2.153592 -1.134133
H -1.814126 1.924005 1.382818
H -2.654267 2.147274 -0.175067
H -3.304366 -0.502886 -1.710472
H -4.009444 0.506365 -0.433801
H 4.261984 1.719196 -0.523341
H 5.461962 0.557279 0.112608
H 5.049695 0.554278 -1.628096
H -0.511574 3.002448 -1.210779
H 0.315136 2.789327 0.347318
H -4.272382 -2.578016 -0.639114
H -4.838682 -1.615165 0.754776
H -5.553934 -1.362199 -0.862226
H -2.099868 4.690254 -0.145518
H -1.260661 4.483083 1.417680
H -0.397314 5.204779 0.030288


