%chk=000186827.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186827

0 1
O -1.483756 2.200297 0.610590
O 1.044383 2.486022 -0.496409
C -2.016925 -0.396889 -0.273286
C -1.226862 -0.086069 1.014611
C -2.931965 -1.654517 -0.118717
C 0.557495 1.130129 -0.319529
C -1.045103 -0.518432 -1.463169
C -0.448886 1.230559 0.872112
C -0.158068 0.722728 -1.617622
C -3.733577 -1.871485 -1.419820
C -2.109977 -2.920852 0.184169
C -3.937336 -1.417615 1.027712
C 1.759449 0.279453 0.079733
C 1.882978 -1.072181 -0.258232
C 2.775478 0.888350 0.837153
C -1.127063 3.567812 0.893145
C 3.005339 -1.804333 0.143204
C 3.895853 0.159140 1.237702
C 4.014277 -1.191340 0.890065
H -2.685216 0.484271 -0.466541
H -1.925821 0.005026 1.869871
H -0.529576 -0.908363 1.259969
H -1.614330 -0.670795 -2.400494
H -0.409753 -1.423421 -1.341769
H 0.091624 1.504916 1.801864
H 0.572194 0.568720 -2.430994
H -0.791692 1.587822 -1.918847
H -3.082312 -2.116628 -2.264199
H -4.446536 -2.695208 -1.312197
H -4.306118 -0.978531 -1.690561
H -1.550048 -2.822880 1.119568
H -1.389984 -3.133991 -0.611678
H -2.757152 -3.798341 0.283064
H -4.533524 -0.514982 0.856778
H -4.632678 -2.256565 1.127241
H -3.432327 -1.297050 1.991863
H 1.684849 2.526609 -1.232707
H 1.095333 -1.568705 -0.835821
H 2.681481 1.942862 1.106943
H -0.302433 3.887567 0.242493
H -0.867071 3.686324 1.947426
H -2.049679 4.106094 0.650975
H 3.090473 -2.854972 -0.128018
H 4.677442 0.641114 1.822262
H 4.887621 -1.760574 1.201699


%chk=000186827-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186827

0 1
O -1.463768 2.308488 0.450235
O 1.121767 2.514627 -0.634338
C -2.033781 -0.424701 -0.271852
C -1.216036 -0.024048 0.985583
C -2.977504 -1.666547 -0.039350
C 0.588490 1.134560 -0.403036
C -1.057753 -0.588530 -1.467385
C -0.447170 1.293352 0.759397
C -0.166684 0.668193 -1.669252
C -3.732050 -2.008454 -1.355607
C -2.196994 -2.924227 0.431169
C -4.045937 -1.309689 1.033774
C 1.780956 0.257256 0.023833
C 2.197388 -0.893424 -0.693057
C 2.558082 0.661731 1.146045
C -1.142566 3.667758 0.899438
C 3.335471 -1.630361 -0.291608
C 3.689444 -0.074760 1.553585
C 4.082301 -1.230710 0.837864
H -2.698446 0.434309 -0.502362
H -1.878607 0.124069 1.855543
H -0.491760 -0.820718 1.244279
H -1.621460 -0.755348 -2.403620
H -0.432501 -1.487690 -1.305656
H 0.091400 1.586610 1.685609
H 0.545207 0.505649 -2.503939
H -0.815498 1.517240 -1.953999
H -3.054295 -2.411338 -2.129505
H -4.507751 -2.773944 -1.163398
H -4.234534 -1.113611 -1.770826
H -1.698808 -2.755979 1.403435
H -1.424532 -3.227228 -0.299976
H -2.889761 -3.778199 0.555817
H -4.605081 -0.398683 0.747396
H -4.772723 -2.137245 1.141493
H -3.596437 -1.133286 2.027425
H 1.853429 2.444717 -1.300205
H 1.645126 -1.220688 -1.578651
H 2.287362 1.578030 1.681393
H -0.275247 4.073760 0.352271
H -0.935607 3.684980 1.991342
H -2.045319 4.266645 0.693456
H 3.638472 -2.514784 -0.863617
H 4.271277 0.256017 2.421562
H 4.962939 -1.802705 1.150898


