%chk=000189013.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189013

0 1
O -0.327674 -1.802130 1.354452
O 2.621024 -1.721878 -1.488429
O -5.586130 0.486140 0.273779
O 6.291104 -0.425767 -0.618682
O -5.955676 -2.143642 0.250266
C -1.197237 1.250444 -0.522324
C -2.156912 0.093550 -0.104383
C 0.136585 1.165312 0.235314
C 0.825267 -0.165935 -0.164753
C 2.226308 -0.324963 0.502510
C -1.519625 -1.225080 -0.575661
C -3.459462 0.505207 -0.873951
C -0.095979 -1.409439 -0.012842
C -2.061350 2.513760 -0.378340
C 1.031355 2.356592 -0.147934
C -3.478747 2.055323 -0.791841
C 3.072614 0.916480 0.223855
C -2.441033 0.045580 1.399168
C 2.423446 2.247640 0.474453
C 2.904890 -1.609561 -0.088113
C 2.172013 -0.460819 2.033105
C -4.710190 -0.120777 -0.302932
C 4.412585 -1.671447 0.142254
C 4.365298 0.849932 -0.134915
C 5.136031 -0.399861 -0.253896
C -4.871468 -1.623718 -0.516488
H -0.968829 1.135777 -1.614403
H -0.045750 1.171092 1.335740
H 1.026467 -0.106532 -1.273387
H -1.485049 -1.279551 -1.678536
H -2.137141 -2.086559 -0.237671
H -3.370556 0.197825 -1.942307
H 0.391472 -2.275905 -0.526331
H -1.699598 3.336262 -1.013946
H -2.055249 2.891796 0.658150
H 0.554237 3.302424 0.175669
H 1.120924 2.429436 -1.250056
H -4.233561 2.394385 -0.055267
H -3.775771 2.489922 -1.759067
H -3.100963 -0.786943 1.669025
H -1.514373 -0.123241 1.971680
H -2.901753 0.968542 1.764300
H 2.361818 2.402494 1.575385
H 3.059289 3.079427 0.103541
H 2.412883 -2.528168 0.312442
H 1.531357 0.315005 2.476273
H 1.754578 -1.427062 2.353809
H 3.165921 -0.369106 2.487318
H 4.841031 -2.530163 -0.423039
H 4.644134 -1.893738 1.204202
H 0.503973 -2.101867 1.781760
H 4.954969 1.748128 -0.337301
H -3.980916 -2.197197 -0.178676
H -5.073777 -1.861394 -1.579083
H 3.134470 -1.070265 -2.011239
H -6.555276 -1.402268 0.538146


%chk=000189013-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189013

0 1
O -0.266693 -1.664942 1.783742
O 2.568902 -1.808653 -1.514808
O -5.556846 0.222944 0.411556
O 6.309203 -0.483299 -1.021147
O -6.255481 -2.165755 -0.571749
C -1.230856 1.232505 -0.341721
C -2.195942 0.086446 0.097013
C 0.148689 1.186895 0.352246
C 0.815958 -0.181926 0.013017
C 2.306567 -0.329821 0.530044
C -1.524536 -1.262151 -0.255754
C -3.443401 0.469939 -0.813349
C -0.096522 -1.408134 0.329653
C -2.096429 2.511171 -0.252275
C 1.029146 2.352776 -0.154312
C -3.515944 2.031542 -0.710229
C 3.112029 0.908757 0.096899
C -2.592330 0.158763 1.594214
C 2.480566 2.257966 0.366431
C 2.937019 -1.629316 -0.096366
C 2.435762 -0.413945 2.092666
C -4.731165 -0.230508 -0.434657
C 4.467064 -1.682155 0.062143
C 4.381114 0.821358 -0.422192
C 5.142221 -0.438628 -0.525341
C -5.053925 -1.568253 -1.108515
H -1.029123 1.060662 -1.426537
H 0.014639 1.287511 1.449078
H 0.906602 -0.206635 -1.095736
H -1.446293 -1.355130 -1.359036
H -2.114891 -2.121802 0.113521
H -3.181609 0.167579 -1.849177
H 0.357805 -2.301601 -0.142748
H -1.712144 3.324283 -0.892813
H -2.123447 2.895260 0.784495
H 0.592340 3.320141 0.156347
H 1.036462 2.342406 -1.264151
H -4.297314 2.317426 0.014297
H -3.797083 2.467027 -1.685488
H -3.250247 -0.688353 1.858055
H -1.706456 0.079990 2.241690
H -3.143454 1.085043 1.830356
H 2.463212 2.414660 1.467027
H 3.106810 3.064014 -0.057298
H 2.488390 -2.514562 0.389111
H 1.655841 0.178696 2.596095
H 2.350304 -1.456257 2.454032
H 3.422195 -0.045071 2.426770
H 4.875731 -2.584014 -0.424910
H 4.738851 -1.736986 1.135335
H 0.517743 -2.163399 2.119198
H 4.918461 1.727948 -0.728930
H -4.198235 -2.263190 -0.982776
H -5.169246 -1.381534 -2.199449
H 3.097597 -1.180073 -2.071009
H -6.631617 -1.504117 0.078244


