%chk=000221716.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221716

0 1
O 0.579322 -0.492994 -1.147515
O -0.194905 1.706366 -1.298800
C 1.782040 1.243708 0.059877
C 1.350131 -0.240774 0.062609
C 0.522090 2.106903 -0.113379
C -0.579304 0.322296 -1.355373
C 2.520759 -1.220068 -0.070649
C 2.533576 1.612047 1.348058
C 2.157505 -2.620768 0.437642
C -1.685168 0.004004 -0.359299
C -0.983227 0.083985 -2.802847
C 3.190519 2.987090 1.269285
C 3.326218 -3.592441 0.295305
C -1.809058 -1.291787 0.157257
C -2.611248 0.991690 -0.001779
C -2.849364 -1.594635 1.039914
C -3.650760 0.686615 0.881227
C -3.769699 -0.605707 1.403363
H 2.443119 1.411924 -0.826454
H 0.700293 -0.467724 0.934771
H -0.155574 2.047369 0.755280
H 0.760873 3.162016 -0.336534
H 3.406121 -0.832242 0.469055
H 2.815201 -1.276112 -1.141201
H 3.311638 0.845217 1.548737
H 1.846571 1.571934 2.216312
H 1.282649 -2.998798 -0.130532
H 1.838235 -2.571435 1.496673
H -0.146090 0.322813 -3.474947
H -1.255605 -0.965149 -2.967108
H -1.830786 0.719964 -3.084113
H 3.877445 3.059488 0.417476
H 2.451361 3.788724 1.160281
H 3.769995 3.199896 2.175321
H 3.639056 -3.694921 -0.750613
H 4.200409 -3.263319 0.867842
H 3.055394 -4.591847 0.654068
H -1.088350 -2.057443 -0.136295
H -2.513187 1.995768 -0.418638
H -2.944830 -2.601397 1.441838
H -4.369585 1.454786 1.159668
H -4.580179 -0.842645 2.090120


%chk=000221716-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221716

0 1
O 0.634873 -0.569605 -1.155014
O -0.162571 1.698195 -1.404589
C 1.844128 1.251993 0.028545
C 1.415043 -0.238948 0.073482
C 0.581011 2.113545 -0.198124
C -0.544304 0.276142 -1.376614
C 2.573684 -1.248116 0.089397
C 2.582706 1.685797 1.322474
C 2.107028 -2.718802 0.178826
C -1.640742 0.010604 -0.323784
C -1.025232 -0.046494 -2.793638
C 3.051077 3.159291 1.318970
C 3.289642 -3.710579 0.194693
C -1.782959 -1.274708 0.254850
C -2.581763 1.019856 -0.003321
C -2.841020 -1.543015 1.151782
C -3.639714 0.753151 0.894259
C -3.772382 -0.529194 1.476173
H 2.518168 1.385631 -0.842423
H 0.761937 -0.395970 0.963021
H -0.077943 2.056415 0.696304
H 0.834238 3.168026 -0.389504
H 3.234929 -1.025653 0.949454
H 3.173741 -1.104205 -0.831507
H 3.467779 1.037378 1.464140
H 1.922675 1.509097 2.197636
H 1.444377 -2.933863 -0.679697
H 1.497181 -2.852536 1.096570
H -0.208172 0.155092 -3.505062
H -1.317262 -1.107176 -2.862248
H -1.894266 0.582195 -3.047930
H 3.662738 3.377778 0.423381
H 2.202619 3.866680 1.329380
H 3.669496 3.373974 2.209550
H 3.896461 -3.615911 -0.725635
H 3.957614 -3.524097 1.057359
H 2.938234 -4.756762 0.259775
H -1.060454 -2.056568 -0.005439
H -2.474201 2.009105 -0.462647
H -2.940445 -2.540771 1.594501
H -4.360616 1.542244 1.137140
H -4.593731 -0.736818 2.171417


