%chk=000244471.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244471

0 1
O 2.421166 -1.106669 -0.251761
O 2.692962 1.111681 0.113684
C -3.796949 -0.557985 0.483659
C -2.477030 -0.316770 -0.261064
C -4.994238 -0.020340 -0.311741
C -1.279611 -0.854139 0.534446
C -6.314808 -0.261682 0.431956
C 0.036021 -0.614053 -0.214020
C -7.511069 0.276483 -0.363953
C -8.833202 0.034716 0.379068
C 1.224009 -1.137432 0.586857
C -10.006353 0.562562 -0.393372
C 3.076836 0.092157 -0.407388
C 4.257616 -0.130456 -1.316007
C 5.560559 0.195898 -0.637460
C -11.013527 1.234833 0.160590
C 5.734462 1.433671 0.000979
C 6.613081 -0.729877 -0.666672
C 6.956395 1.741531 0.601938
C 7.834757 -0.413417 -0.064470
C 8.009477 0.820578 0.568560
H -3.928994 -1.640064 0.676787
H -3.760762 -0.075916 1.479875
H -2.513762 -0.796629 -1.258172
H -2.345537 0.766244 -0.452702
H -4.863008 1.062392 -0.503366
H -5.030282 -0.500299 -1.308763
H -1.413866 -1.935974 0.729525
H -1.242127 -0.366580 1.528783
H -6.278365 0.219570 1.428538
H -6.446284 -1.343916 0.624622
H 0.011816 -1.101481 -1.208691
H 0.173892 0.469643 -0.413824
H -7.545257 -0.200698 -1.362351
H -7.384151 1.360875 -0.551204
H -8.979303 -1.052776 0.552910
H -8.784342 0.489576 1.389311
H 1.414307 -0.549950 1.501834
H 1.155973 -2.215114 0.819711
H -9.987760 0.343457 -1.462908
H 4.251719 -1.178657 -1.695246
H 4.136828 0.513434 -2.218740
H -11.861765 1.597628 -0.400478
H -11.071718 1.476332 1.211257
H 4.906691 2.146503 0.038681
H 6.484826 -1.694593 -1.153185
H 7.088106 2.701740 1.098996
H 8.651413 -1.133243 -0.088564
H 8.961159 1.064008 1.036434


%chk=000244471-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244471

0 1
O 2.524405 -0.835666 -0.465433
O 2.758958 1.448543 -0.039556
C -3.806350 -0.428975 0.497823
C -2.513997 -0.303769 -0.339590
C -5.083424 -0.085469 -0.302033
C -1.233447 -0.641165 0.457549
C -6.381792 -0.236868 0.521727
C 0.047440 -0.526163 -0.401999
C -7.654881 0.113632 -0.280792
C -8.957448 -0.064534 0.544681
C 1.306150 -0.869871 0.404583
C -10.207191 0.223338 -0.260219
C 3.157316 0.400477 -0.600035
C 4.392954 0.283297 -1.485882
C 5.684427 0.293097 -0.663796
C -11.148452 1.150430 0.050302
C 6.024545 1.417178 0.132379
C 6.560879 -0.819273 -0.694143
C 7.222957 1.427192 0.879281
C 7.762387 -0.808571 0.051808
C 8.097558 0.315610 0.840051
H -3.888685 -1.463271 0.892966
H -3.737612 0.237583 1.382790
H -2.583005 -0.974406 -1.221460
H -2.433570 0.728429 -0.738982
H -5.009069 0.954831 -0.681886
H -5.140558 -0.739282 -1.197580
H -1.317593 -1.670014 0.866068
H -1.157228 0.039154 1.330813
H -6.325117 0.411442 1.421020
H -6.459720 -1.279708 0.895210
H -0.024385 -1.207392 -1.272147
H 0.140274 0.504253 -0.794225
H -7.706097 -0.526276 -1.186376
H -7.594317 1.160119 -0.640808
H -8.991710 -1.111133 0.916946
H -8.927032 0.590205 1.437617
H 1.450458 -0.161005 1.239861
H 1.283060 -1.906349 0.780153
H -10.334473 -0.379760 -1.174228
H 4.323269 -0.640041 -2.081925
H 4.380823 1.150021 -2.172320
H -12.030000 1.311215 -0.580713
H -11.061824 1.775587 0.948159
H 5.341977 2.273889 0.172481
H 6.303173 -1.695342 -1.301426
H 7.475004 2.301051 1.490736
H 8.432518 -1.675040 0.017324
H 9.028444 0.325574 1.418126


