%chk=000236825.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236825

0 1
O 0.283648 2.286885 -0.898249
O -3.657505 -2.645010 1.342421
O -5.330313 -0.012561 -0.477528
O 6.482441 0.139386 1.050376
O -5.391524 2.644118 -0.154715
C -1.869985 0.130891 0.003017
C -0.979535 -1.133275 0.215963
C 0.390632 -0.968111 -0.455810
C 1.117658 0.220892 0.228271
C -3.222522 -0.354326 0.621066
C -1.199721 1.295039 0.746034
C 2.541805 0.451644 -0.375841
C 0.266131 1.518069 0.306878
C -1.881404 -2.305091 -0.197432
C -3.305130 -1.856434 0.197130
C 1.221449 -2.252279 -0.286022
C -2.096259 0.479548 -1.474739
C 3.327424 -0.861942 -0.314054
C 2.635033 -2.086403 -0.846108
C 3.247018 1.547495 0.471252
C 2.510792 0.876735 -1.852861
C -4.423932 0.443025 0.186049
C 4.758534 1.591583 0.264706
C 4.598736 -0.933153 0.110439
C 5.386729 0.239918 0.539764
C -4.497710 1.891318 0.659469
H -0.798549 -1.245474 1.319317
H 0.267792 -0.757558 -1.543331
H 1.283155 -0.084236 1.298229
H -3.154980 -0.322674 1.737902
H -1.228213 1.124125 1.838276
H -1.761229 2.239476 0.573540
H 0.748990 2.235710 1.017881
H -1.816076 -2.528667 -1.273845
H -1.616677 -3.237238 0.337812
H -4.054103 -2.017640 -0.605499
H 0.717749 -3.098027 -0.792723
H 1.276242 -2.535498 0.784267
H -2.725473 1.371349 -1.595388
H -1.148716 0.684616 -1.996878
H -2.586980 -0.335496 -2.020502
H 2.603445 -2.015488 -1.955796
H 3.225014 -3.002689 -0.632918
H 3.039394 1.382557 1.547194
H 2.812853 2.537372 0.220245
H 2.109240 1.896933 -1.956898
H 3.517116 0.883337 -2.287135
H 1.890856 0.211740 -2.460538
H 5.219673 2.362538 0.915139
H 5.010931 1.897761 -0.771461
H -0.130032 1.785228 -1.642997
H 5.146202 -1.876100 0.158481
H -4.626141 -2.658992 1.470423
H -3.528727 2.430028 0.566021
H -4.841181 1.946302 1.711793
H -6.141667 2.066748 -0.458688


%chk=000236825-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236825

0 1
O 0.337038 2.373760 -1.174273
O -3.708371 -2.645405 1.283752
O -5.165910 0.350249 -0.769220
O 6.550659 0.169280 1.294942
O -5.927875 2.446603 0.720340
C -1.877281 0.196656 -0.151744
C -1.006240 -1.081528 0.068380
C 0.407983 -0.974485 -0.537735
C 1.135326 0.267620 0.073836
C -3.212090 -0.291829 0.556281
C -1.172236 1.377644 0.554722
C 2.625622 0.447000 -0.436277
C 0.295292 1.589509 0.081072
C -1.934512 -2.242351 -0.350344
C -3.345259 -1.801006 0.131909
C 1.222426 -2.253713 -0.224155
C -2.158756 0.486301 -1.653899
C 3.372600 -0.877060 -0.186969
C 2.696052 -2.143356 -0.679015
C 3.288202 1.600688 0.378261
C 2.727756 0.754566 -1.967642
C -4.428903 0.546616 0.244661
C 4.828664 1.608819 0.306620
C 4.617047 -0.928480 0.387754
C 5.416886 0.265173 0.732109
C -4.793700 1.688678 1.193991
H -0.866791 -1.166659 1.171094
H 0.334058 -0.873724 -1.641161
H 1.235111 0.023991 1.158989
H -3.022072 -0.270868 1.648854
H -1.154933 1.180186 1.646815
H -1.703818 2.335897 0.399130
H 0.771867 2.286511 0.791036
H -1.923850 -2.390227 -1.445956
H -1.676221 -3.202798 0.124518
H -4.108789 -1.898389 -0.663868
H 0.752514 -3.130635 -0.708301
H 1.190140 -2.433418 0.870461
H -2.549637 1.509893 -1.795133
H -1.250014 0.371510 -2.274444
H -2.912178 -0.202000 -2.072703
H 2.721100 -2.145316 -1.789791
H 3.268184 -3.030410 -0.351552
H 2.993283 1.496226 1.443173
H 2.894026 2.569292 0.021386
H 2.319806 1.755160 -2.178186
H 3.783141 0.721011 -2.293733
H 2.177423 0.016651 -2.578582
H 5.259828 2.403076 0.941042
H 5.167886 1.811870 -0.729757
H -0.119219 1.873154 -1.895063
H 5.105842 -1.894871 0.569928
H -4.677636 -2.555338 1.465910
H -3.916516 2.357589 1.318337
H -5.012073 1.248817 2.192621
H -6.248485 1.991873 -0.111018


