%chk=000185281.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185281

0 1
O -3.334006 -0.708140 0.201908
O -6.482624 -0.623568 0.091012
C 1.692517 1.958866 -0.107264
C 2.793389 1.055254 0.515939
C 2.941362 -0.299668 -0.186420
C 0.340784 1.245998 -0.101148
C 2.131192 2.373102 -1.524754
C 1.551667 3.234984 0.752726
C 4.032824 -1.154374 0.471688
C 4.178529 -2.513318 -0.227741
C -0.498894 1.220142 -1.218200
C -0.097370 0.616226 1.084611
C -1.745744 0.579392 -1.183867
C -1.326012 -0.026094 1.151893
C 5.263422 -3.370128 0.421228
C -2.144060 -0.037577 0.003102
C -4.269086 -0.792778 -0.913435
C -5.459892 -1.540135 -0.309269
H 3.758568 1.596215 0.490259
H 2.576845 0.893812 1.589421
H 1.974340 -0.840901 -0.167445
H 3.177089 -0.146972 -1.257277
H 2.199266 1.507782 -2.193314
H 1.439133 3.094346 -1.971120
H 3.119531 2.845488 -1.507297
H 2.482111 3.810189 0.773026
H 0.767452 3.890001 0.357321
H 1.283776 3.002130 1.787921
H 4.999743 -0.616448 0.450390
H 3.798686 -1.308497 1.542392
H 4.413268 -2.361763 -1.299400
H 3.211644 -3.053453 -0.203910
H -0.200103 1.704627 -2.148300
H 0.542888 0.629683 1.968598
H -2.370764 0.577344 -2.069106
H -1.668245 -0.515603 2.059786
H 5.359505 -4.337209 -0.084685
H 5.041140 -3.572020 1.475186
H 6.242651 -2.879902 0.381332
H -3.788229 -1.347401 -1.736028
H -4.543541 0.226327 -1.239148
H -5.145900 -2.154547 0.557837
H -5.972646 -2.174188 -1.057703
H -6.162106 -0.063727 0.831555


%chk=000185281-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185281

0 1
O -3.485791 -0.654434 0.243143
O -6.335699 -0.610269 0.508668
C 1.684758 1.983460 -0.112165
C 2.789588 1.046951 0.490217
C 3.026756 -0.285119 -0.255056
C 0.307366 1.279621 -0.080701
C 2.094686 2.410211 -1.545566
C 1.609923 3.271299 0.765245
C 4.047751 -1.194128 0.467610
C 4.313356 -2.523642 -0.274597
C -0.492055 1.091025 -1.233062
C -0.218044 0.800318 1.154356
C -1.757164 0.457332 -1.177026
C -1.469753 0.166668 1.234816
C 5.329339 -3.428983 0.455271
C -2.247437 -0.006607 0.064040
C -4.345040 -0.843681 -0.941181
C -5.621555 -1.495682 -0.413334
H 3.738985 1.621704 0.525016
H 2.530858 0.819825 1.544855
H 2.065060 -0.826352 -0.359097
H 3.390478 -0.085960 -1.283237
H 2.134966 1.555770 -2.244154
H 1.393150 3.158577 -1.958862
H 3.099594 2.871068 -1.522861
H 2.583670 3.797069 0.760667
H 0.839082 3.964543 0.381662
H 1.358245 3.033831 1.814774
H 5.006619 -0.647710 0.593037
H 3.680948 -1.415620 1.492082
H 4.681162 -2.302451 -1.297562
H 3.354635 -3.067030 -0.400331
H -0.138046 1.440628 -2.207467
H 0.362877 0.921414 2.076020
H -2.336497 0.335528 -2.097431
H -1.861312 -0.200396 2.188888
H 5.498091 -4.374789 -0.091995
H 4.972677 -3.685275 1.470933
H 6.306784 -2.921406 0.562599
H -3.837716 -1.493475 -1.683931
H -4.571767 0.140072 -1.398862
H -5.369043 -2.461121 0.072955
H -6.319804 -1.685552 -1.245893
H -5.690583 -0.333735 1.209821


