%chk=000247141.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247141

0 1
O 1.355424 -2.595233 -0.150481
O -3.324051 0.130003 -0.648343
O 2.178907 1.942698 0.683670
O 0.892769 -0.357847 2.108168
O 2.631137 -0.955689 -1.041743
O -4.987834 0.739014 0.755255
O 1.326159 2.654371 -1.283152
N -0.414507 -0.007789 0.287621
C -0.724885 -1.456379 0.185047
C -1.087479 0.864801 -0.697009
C 0.158418 -2.147663 -0.875888
C -2.493429 1.271728 -0.218776
C 0.453937 0.434115 1.286949
C 0.857106 1.928055 1.300622
C -0.456857 -3.428862 -1.409059
C -3.007424 2.522873 -0.905665
C 1.065490 2.424206 2.715878
C 2.489944 -1.816888 -0.200316
C -4.571158 -0.023944 -0.082095
C 3.393498 -2.228444 0.924488
C -5.227873 -1.231526 -0.696742
C 2.283619 2.247048 -0.664596
C 3.687886 1.960408 -1.097489
C 4.857810 -1.994938 0.590851
C -5.775994 -2.150130 0.386830
C 4.133600 2.899366 -2.206636
H -0.544697 -1.941552 1.179269
H -1.805871 -1.581719 -0.054510
H -0.468566 1.775390 -0.913947
H -1.168783 0.335976 -1.677269
H 0.475168 -1.457222 -1.690309
H -2.574251 1.339445 0.888898
H 0.170691 2.582081 0.715658
H 0.242426 -3.945998 -2.081309
H -1.378359 -3.235000 -1.968376
H -0.686612 -4.135433 -0.599860
H -2.367860 3.391997 -0.709098
H -3.069968 2.398182 -1.994250
H -4.018347 2.775275 -0.549708
H 1.573083 3.397449 2.723286
H 0.116242 2.522344 3.255761
H 1.698440 1.724786 3.289799
H 3.206125 -3.286853 1.207559
H 3.080912 -1.631492 1.821497
H -4.513507 -1.773661 -1.353084
H -6.046770 -0.881601 -1.364013
H 3.710833 0.888513 -1.439957
H 4.381523 1.997984 -0.229836
H 5.196615 -2.640765 -0.228870
H 5.037710 -0.955492 0.282501
H 5.495728 -2.198109 1.459709
H -4.975347 -2.585706 0.997748
H -6.447621 -1.608696 1.070276
H -6.347427 -2.978533 -0.049203
H 3.418284 2.900794 -3.042554
H 4.223174 3.934643 -1.854988
H 5.109018 2.598220 -2.607715


%chk=000247141-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247141

0 1
O 1.557832 -2.815620 -0.340945
O -3.272504 0.027154 -0.625815
O 2.051437 1.701461 0.874968
O 0.705554 -0.806627 2.063819
O 2.621716 -0.916158 -1.195569
O -4.619512 1.241215 0.845906
O 1.329103 2.811611 -1.051770
N -0.412385 -0.380460 0.064277
C -0.688398 -1.825132 -0.119217
C -0.919169 0.528739 -0.988961
C 0.292161 -2.525839 -1.090125
C -2.284751 1.162589 -0.671624
C 0.303210 0.021531 1.185939
C 0.632063 1.527784 1.355383
C -0.236471 -3.879785 -1.570585
C -2.719952 2.177944 -1.735452
C 0.606651 1.938126 2.825418
C 2.603886 -1.889582 -0.403372
C -4.415493 0.209339 0.168151
C 3.654205 -2.233571 0.635279
C -5.334271 -0.997545 0.057853
C 2.259321 2.326064 -0.360712
C 3.726480 2.288125 -0.735850
C 5.004936 -1.536692 0.397237
C -6.394841 -1.042674 1.173372
C 4.106797 3.349157 -1.784721
H -0.613752 -2.316102 0.866244
H -1.718434 -1.929057 -0.503441
H -0.197045 1.337886 -1.189860
H -1.010369 -0.053355 -1.923713
H 0.549165 -1.864105 -1.939509
H -2.285334 1.632818 0.329873
H -0.006611 2.183390 0.740943
H 0.521087 -4.391887 -2.187017
H -1.147508 -3.741338 -2.180475
H -0.482710 -4.532459 -0.714385
H -1.986759 3.002976 -1.790812
H -2.783744 1.703027 -2.730787
H -3.703684 2.605368 -1.480464
H 0.957512 2.978213 2.935389
H -0.423211 1.869208 3.220343
H 1.245392 1.263169 3.416295
H 3.757900 -3.332619 0.679297
H 3.219233 -1.927769 1.608426
H -4.713121 -1.911741 0.046781
H -5.820069 -0.949551 -0.937553
H 3.900964 1.265390 -1.128544
H 4.331948 2.378086 0.183579
H 5.447924 -1.834337 -0.569616
H 4.882218 -0.440610 0.390865
H 5.716008 -1.800408 1.199843
H -5.924068 -1.154971 2.165352
H -6.985415 -0.111297 1.191207
H -7.081309 -1.893068 1.016520
H 3.465319 3.261903 -2.677754
H 3.988325 4.371940 -1.385403
H 5.158742 3.218751 -2.094015


