%chk=000256608.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256608

0 1
O -2.192943 0.518987 -0.621625
O -2.492100 1.254396 1.525014
O 1.464315 -0.829900 -3.133432
O 3.803214 -0.784549 -2.094138
C -4.397277 1.022696 -0.046761
C -5.229940 -0.003358 0.742259
C -4.838094 -1.446110 0.400716
C -4.940589 2.453871 0.124976
C -5.669481 -2.454834 1.205523
C -2.967919 0.981326 0.460850
C -4.220949 3.454570 -0.771750
C -5.289250 -3.893309 0.863981
C -0.823641 0.325337 -0.613891
C -0.339999 -0.153472 -1.828246
C 0.017579 0.584008 0.489359
C 1.927003 -0.158745 -0.842081
C 1.045383 -0.385520 -1.937909
C 1.373257 0.341667 0.358241
C 3.352999 -0.431411 -1.002758
C 4.272510 -0.279908 0.166707
C 4.133967 -1.113793 1.284739
C 5.296379 0.674739 0.116968
C 5.016962 -0.981456 2.359428
C 6.171299 0.807734 1.199421
C 6.032017 -0.018883 2.318849
H -4.409138 0.751985 -1.137022
H -5.121980 0.175556 1.831816
H -6.304401 0.154497 0.519190
H -3.759935 -1.609473 0.598194
H -4.970220 -1.630929 -0.683533
H -6.025269 2.456625 -0.106386
H -4.857077 2.766232 1.186945
H -5.528347 -2.279582 2.290547
H -6.748464 -2.297630 1.010542
H -3.155850 3.540720 -0.522110
H -4.285118 3.177997 -1.831261
H -4.654977 4.457166 -0.670824
H -5.452041 -4.115179 -0.197054
H -4.233699 -4.095488 1.081023
H -5.884484 -4.608516 1.443075
H -0.997703 -0.341925 -2.674226
H -0.397131 0.968591 1.423757
H 2.037951 0.546169 1.203872
H 3.346254 -1.867107 1.311671
H 5.412289 1.305439 -0.765285
H 2.504137 -0.967883 -3.172057
H 4.915707 -1.630139 3.228435
H 6.965731 1.552166 1.166098
H 6.717463 0.083724 3.159553


%chk=000256608-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000256608

0 1
O -2.235862 0.558794 -0.724195
O -2.674973 1.219482 1.499778
O 1.661129 -0.532996 -3.196528
O 3.939328 -0.364047 -2.150786
C -4.529652 0.976653 -0.112422
C -5.351872 -0.074688 0.689615
C -4.903642 -1.535605 0.463473
C -5.106442 2.409765 0.080536
C -5.784880 -2.552114 1.224723
C -3.080300 0.947321 0.351917
C -4.398101 3.486168 -0.768573
C -5.338105 -4.013768 1.007766
C -0.820349 0.425291 -0.661701
C -0.257558 -0.002756 -1.875366
C -0.013869 0.716129 0.477880
C 1.989537 0.056368 -0.826903
C 1.141779 -0.165839 -1.981177
C 1.370533 0.526334 0.369560
C 3.436966 -0.166302 -0.967005
C 4.376616 -0.191991 0.195890
C 4.037874 -0.784069 1.443318
C 5.689605 0.316930 0.003055
C 4.990628 -0.842101 2.483355
C 6.632166 0.274737 1.049450
C 6.284062 -0.302581 2.294581
H -4.547939 0.715359 -1.186460
H -5.289987 0.174476 1.767677
H -6.414624 0.033808 0.393315
H -3.849500 -1.660813 0.786194
H -4.926635 -1.768238 -0.621319
H -6.181556 2.374280 -0.182628
H -5.044185 2.672462 1.154201
H -5.761988 -2.313164 2.307503
H -6.839827 -2.434176 0.902245
H -3.333007 3.586725 -0.489226
H -4.442494 3.241127 -1.846027
H -4.872849 4.473581 -0.625464
H -5.379029 -4.286620 -0.063653
H -4.297569 -4.164972 1.351683
H -5.982917 -4.720524 1.561499
H -0.889682 -0.189785 -2.745985
H -0.463958 1.080265 1.400134
H 2.000366 0.778944 1.227185
H 3.052309 -1.239015 1.585156
H 5.950434 0.735667 -0.974143
H 2.695839 -0.522871 -3.090302
H 4.726856 -1.315085 3.435436
H 7.636887 0.682813 0.895795
H 7.018836 -0.342259 3.106341


