%chk=000250829.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250829

0 1
O -2.149157 -1.350727 -0.389257
O -3.456823 0.372212 0.411211
O 3.278272 -0.479061 1.531918
O 0.736230 2.966478 1.122083
O 3.187685 -0.162845 -0.707871
C 0.248966 0.131664 -0.036764
C -1.097910 0.513189 0.577927
C 1.425584 0.719641 0.767374
C -2.259246 0.072898 -0.316280
C 1.499765 2.236456 0.535136
C 2.697554 -0.000570 0.385157
C 2.521292 2.738762 -0.431576
C -3.247945 -2.041191 -1.041486
C -4.518042 1.024144 -0.335199
C 4.506076 -1.269575 1.413830
C -2.808554 -3.494183 -1.061768
C -5.719728 0.945855 0.588814
C 4.171258 -2.669673 0.946627
H 0.326432 -0.978518 -0.068201
H 0.312940 0.460917 -1.093201
H -1.221764 0.041225 1.577093
H -1.169928 1.606992 0.764180
H 1.232054 0.556006 1.866791
H -2.268832 0.509448 -1.331562
H 2.279803 3.755010 -0.777637
H 3.519414 2.790617 0.028546
H 2.622023 2.094039 -1.321308
H -4.156397 -1.880230 -0.432966
H -3.383696 -1.624855 -2.053509
H -4.202547 2.065111 -0.528077
H -4.684252 0.496813 -1.289200
H 4.874604 -1.231688 2.455553
H 5.196046 -0.744640 0.730145
H -3.587965 -4.144321 -1.471174
H -2.570894 -3.841155 -0.045748
H -1.896928 -3.627580 -1.658015
H -6.586213 1.468265 0.171552
H -5.487618 1.392048 1.567230
H -6.002802 -0.096377 0.786935
H 3.373696 -3.118062 1.553934
H 3.822264 -2.669669 -0.097174
H 5.043984 -3.331171 1.001336


%chk=000250829-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250829

0 1
O -2.231322 -1.483276 -0.259549
O -3.579472 0.379663 0.447136
O 3.514483 -0.474473 1.525809
O 0.966826 2.765903 1.760345
O 3.033891 -0.321150 -0.754189
C 0.207471 0.015617 0.073621
C -1.153916 0.460983 0.645342
C 1.418015 0.525593 0.923084
C -2.329335 -0.036008 -0.200043
C 1.493007 2.074567 0.851121
C 2.706132 -0.127252 0.441590
C 2.165509 2.707584 -0.357286
C -3.274548 -2.123630 -1.082532
C -4.532010 1.092331 -0.428124
C 4.821132 -1.134846 1.204703
C -2.954620 -3.616166 -1.147429
C -5.778241 1.382542 0.407056
C 4.637995 -2.647242 1.053240
H 0.235278 -1.087715 0.047675
H 0.329212 0.355276 -0.973527
H -1.289925 0.064675 1.668639
H -1.225273 1.560983 0.717020
H 1.261472 0.266700 1.984193
H -2.303508 0.378429 -1.239731
H 1.836418 3.753018 -0.462797
H 3.263309 2.702373 -0.208107
H 1.975309 2.137071 -1.281887
H -4.265016 -1.946073 -0.617892
H -3.273729 -1.667563 -2.099061
H -4.075167 2.037799 -0.791691
H -4.784518 0.468324 -1.312899
H 5.456838 -0.876870 2.066527
H 5.223743 -0.683797 0.280537
H -3.717176 -4.148228 -1.745242
H -2.941452 -4.048561 -0.132139
H -1.965829 -3.784770 -1.608025
H -6.527585 1.929701 -0.193933
H -5.516742 1.995912 1.286247
H -6.231745 0.442741 0.766544
H 4.175650 -3.080245 1.956870
H 4.005685 -2.879863 0.180147
H 5.622455 -3.128356 0.904039


