%chk=000233451.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233451

0 1
O 4.244379 0.096680 0.256619
O 4.226861 2.024277 -0.932179
C -1.195086 0.242720 -0.456017
C -0.557371 -0.992838 0.248808
C 0.854584 -1.175517 -0.324433
C -2.645950 0.492023 0.075980
C 1.745185 0.067790 0.000692
C -3.473107 -0.805857 -0.195971
C -0.301990 1.497541 -0.327772
C 1.155795 1.264782 -0.759898
C -1.415597 -2.251939 0.035162
C 3.123024 -0.440835 -0.521051
C 1.711505 -2.372713 0.124864
C -2.856987 -2.027795 0.506701
C -3.303612 1.644496 -0.732286
C 3.158578 -1.956193 -0.227226
C -4.951080 -0.628266 0.197165
C -2.624562 0.855398 1.569798
C 1.851262 0.376995 1.499670
C -4.790626 1.827947 -0.400466
C -5.583845 0.528050 -0.588164
C 4.702856 1.355483 -0.044135
C 5.827836 1.695382 0.873513
H -1.275974 0.002505 -1.544929
H -0.493622 -0.789597 1.345538
H 0.752314 -1.247880 -1.438804
H -3.438652 -0.994314 -1.299150
H -0.319205 1.862877 0.717717
H -0.728942 2.315725 -0.938827
H 1.208337 1.095836 -1.851533
H 1.763255 2.174081 -0.581581
H -0.970993 -3.104256 0.581550
H -1.409900 -2.541382 -1.032752
H 3.302487 -0.185864 -1.582372
H 1.419640 -3.302103 -0.386745
H 1.603688 -2.560673 1.205997
H -3.463008 -2.928930 0.298385
H -2.883641 -1.893546 1.604254
H -3.190438 1.446699 -1.814765
H -2.767298 2.591988 -0.539304
H 3.852414 -2.162518 0.608900
H 3.542051 -2.516724 -1.093789
H -5.037665 -0.440412 1.283971
H -5.508558 -1.562961 0.003969
H -2.101879 1.801543 1.742946
H -3.639912 0.962420 1.967029
H -2.119023 0.085080 2.162429
H 2.396737 1.310966 1.668924
H 0.861347 0.478814 1.959657
H 2.388629 -0.413787 2.035340
H -5.217378 2.623552 -1.039618
H -4.899462 2.184044 0.642293
H -6.630965 0.675235 -0.265205
H -5.629465 0.269552 -1.663521
H 6.652226 0.971094 0.785015
H 5.506647 1.678461 1.926291
H 6.226259 2.696864 0.651515


%chk=000233451-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000233451

0 1
O 4.308946 0.263073 0.213095
O 4.479178 1.600508 -1.702157
C -1.205053 0.298270 -0.233193
C -0.592062 -1.011601 0.372693
C 0.864754 -1.146079 -0.112880
C -2.719529 0.496390 0.164313
C 1.764610 0.069885 0.281407
C -3.498051 -0.788771 -0.307400
C -0.309531 1.541273 0.045492
C 1.172955 1.340532 -0.370092
C -1.434061 -2.252032 -0.017351
C 3.104256 -0.434016 -0.327129
C 1.704210 -2.386139 0.301733
C -2.929435 -2.078852 0.325445
C -3.315186 1.716051 -0.611239
C 3.186288 -1.941534 0.044900
C -5.030460 -0.665664 -0.128945
C -2.870223 0.737916 1.692477
C 1.914764 0.252877 1.814692
C -4.850402 1.856711 -0.468361
C -5.588672 0.562953 -0.883447
C 4.899402 1.259166 -0.572906
C 6.105685 1.835487 0.139834
H -1.201402 0.148277 -1.340015
H -0.590938 -0.934966 1.480673
H 0.821122 -1.147084 -1.228078
H -3.313721 -0.862693 -1.405566
H -0.354932 1.804810 1.119732
H -0.707914 2.414111 -0.504442
H 1.237994 1.246202 -1.473585
H 1.762125 2.237732 -0.095573
H -1.027198 -3.152979 0.482642
H -1.332499 -2.421050 -1.111409
H 3.094614 -0.275437 -1.422241
H 1.434953 -3.284455 -0.280625
H 1.543589 -2.630687 1.368825
H -3.504083 -2.952988 -0.042394
H -3.067076 -2.055982 1.425567
H -3.063676 1.605247 -1.688381
H -2.836115 2.653275 -0.267782
H 3.811606 -2.060704 0.947266
H 3.663890 -2.523514 -0.762204
H -5.287681 -0.596019 0.947921
H -5.512560 -1.591658 -0.502912
H -2.403519 1.696778 1.984063
H -3.930390 0.788423 1.995031
H -2.398886 -0.059087 2.293675
H 2.620092 1.076274 2.025391
H 0.951987 0.500228 2.291744
H 2.311323 -0.652296 2.307252
H -5.200677 2.707953 -1.084985
H -5.108205 2.105930 0.580441
H -6.676775 0.667286 -0.704296
H -5.457551 0.404679 -1.974467
H 6.836801 1.037241 0.355466
H 5.803048 2.272015 1.107565
H 6.572374 2.608733 -0.487080


