%chk=000228671.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228671

0 1
O 2.107109 -0.923402 -0.452340
O -1.062407 -0.801976 0.256171
O 3.066740 0.356904 1.141435
C -2.610949 1.108255 1.456828
C 3.846983 0.468447 -1.204807
C -3.075824 0.391783 0.207171
C -2.367657 2.608407 1.179092
C 3.573589 1.964046 -1.455076
C 5.335030 0.205839 -0.907849
C 1.154100 -1.480273 0.518635
C -2.257134 -0.593258 -0.406041
C 3.019121 0.016081 -0.015698
C -3.624453 0.921799 2.593885
C -0.099077 -1.723265 -0.332332
C -4.305515 0.666647 -0.389652
C -1.178017 2.831436 0.249200
C 2.149608 2.214974 -1.939064
C 5.655821 -1.284084 -0.852833
C 1.767245 -2.745137 1.087919
C -2.651922 -1.276383 -1.559043
C -4.718894 -0.007648 -1.549561
C -3.896417 -0.971745 -2.127029
H -1.636723 0.655708 1.787621
H 3.539170 -0.119608 -2.108399
H -3.276195 3.067480 0.745797
H -2.192262 3.132171 2.139062
H 4.296045 2.344803 -2.204344
H 3.766322 2.541667 -0.526784
H 5.617404 0.690044 0.050716
H 5.953227 0.693397 -1.687837
H 0.960461 -0.710014 1.307200
H -4.574378 1.424910 2.387301
H -3.844423 -0.140747 2.751160
H -3.237433 1.320667 3.537557
H 0.075536 -1.461386 -1.393023
H -0.500288 -2.745642 -0.244526
H -4.959006 1.419814 0.051342
H -0.250887 2.435368 0.681396
H -1.023189 3.896669 0.050158
H -1.326725 2.328875 -0.714679
H 1.939275 1.694427 -2.880621
H 1.402208 1.876242 -1.208889
H 1.972668 3.283723 -2.108353
H 5.094087 -1.792619 -0.059247
H 6.721018 -1.450377 -0.652290
H 5.416941 -1.788852 -1.796226
H 1.068832 -3.268848 1.752243
H 2.663849 -2.508347 1.679783
H 2.078172 -3.441648 0.299533
H -2.023322 -2.030549 -2.018121
H -5.683008 0.227212 -1.992837
H -4.215660 -1.497085 -3.026006


%chk=000228671-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228671

0 1
O 2.003260 -1.096833 -0.408681
O -0.896476 -0.847261 0.171416
O 3.259676 -0.372094 1.418737
C -2.138201 1.574200 0.847371
C 3.723004 0.554234 -0.826563
C -2.839923 0.547114 -0.046646
C -2.479203 3.050866 0.512210
C 3.431732 2.050362 -0.504463
C 5.249121 0.259275 -0.796377
C 1.204121 -1.990919 0.494939
C -2.195658 -0.688309 -0.358336
C 3.007164 -0.326711 0.190833
C -2.449546 1.262486 2.339614
C -0.179971 -2.088972 -0.137151
C -4.151266 0.735641 -0.540267
C -2.051253 3.487317 -0.905692
C 1.945694 2.439565 -0.649793
C 5.613292 -1.176407 -1.230863
C 1.911256 -3.349430 0.601558
C -2.837814 -1.680336 -1.138064
C -4.810487 -0.246626 -1.316609
C -4.148643 -1.455123 -1.615929
H -1.048013 1.442572 0.706693
H 3.318838 0.313865 -1.827834
H -3.563904 3.233725 0.653192
H -1.968409 3.689388 1.260873
H 4.047285 2.667142 -1.188614
H 3.781608 2.260935 0.524820
H 5.622249 0.450304 0.228200
H 5.748145 0.987688 -1.465331
H 1.142506 -1.504138 1.484959
H -3.529286 1.384111 2.548323
H -2.165445 0.226207 2.594099
H -1.889765 1.946353 3.005093
H -0.086789 -2.222765 -1.233513
H -0.724855 -2.956276 0.290335
H -4.671449 1.673318 -0.315080
H -0.962619 3.349153 -1.045122
H -2.283886 4.553699 -1.083260
H -2.565585 2.892436 -1.681705
H 1.579772 2.240451 -1.674445
H 1.306024 1.867374 0.047011
H 1.799304 3.514314 -0.436793
H 5.172486 -1.926987 -0.548685
H 6.708490 -1.324221 -1.225034
H 5.246359 -1.390605 -2.252111
H 1.354563 -4.022004 1.279347
H 2.924010 -3.213630 1.015429
H 1.994957 -3.834649 -0.387351
H -2.337029 -2.623243 -1.376166
H -5.826826 -0.066501 -1.682884
H -4.643818 -2.225152 -2.217992


