%chk=000251593.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251593

0 1
O -5.095314 0.648313 0.620779
O -3.625853 1.882500 -1.269577
O 5.840610 0.018894 0.686734
C -1.775390 -0.987866 0.392549
C -2.609425 0.322622 0.235734
C -0.416082 -0.876220 -0.311194
C 0.371025 0.289152 0.353883
C 1.778218 0.479385 -0.302974
C -1.859441 1.464206 0.928111
C -0.438911 1.604757 0.354630
C -3.943155 -0.126079 0.911105
C -2.754026 -2.103904 -0.022063
C 0.380986 -2.183269 -0.174673
C -4.139539 -1.591754 0.430642
C 2.522960 -0.856485 -0.348429
C -2.842630 0.663204 -1.254124
C 1.755887 -2.055816 -0.834072
C 2.571038 1.497777 0.563020
C 1.674539 0.987048 -1.752327
C 4.060834 1.540379 0.234923
C 3.827317 -0.971331 -0.049332
C 4.687689 0.163715 0.337159
H -1.568260 -1.125992 1.487325
H -0.560742 -0.655117 -1.394091
H 0.546374 0.001306 1.422163
H -1.821068 1.297280 2.019942
H -2.417402 2.413667 0.783820
H -0.504628 2.007431 -0.675769
H 0.103177 2.372873 0.939816
H -3.878405 -0.070880 2.020344
H -2.500971 -3.062109 0.458725
H -2.729435 -2.288846 -1.107732
H -0.177467 -3.020871 -0.634245
H 0.500723 -2.452541 0.893367
H -4.880340 -1.625094 -0.385271
H -4.559006 -2.210543 1.238871
H -3.409568 -0.124933 -1.778225
H -1.893441 0.858790 -1.784052
H 1.646140 -1.976986 -1.937994
H 2.331913 -2.990416 -0.667586
H 2.446057 1.243691 1.635690
H 2.138163 2.509403 0.439959
H 1.039147 0.337291 -2.363744
H 1.249443 1.996286 -1.793719
H 2.660313 1.030864 -2.230463
H 4.589706 2.244373 0.909512
H 4.234800 1.933436 -0.787612
H 4.349013 -1.929783 -0.078849
H -4.970556 1.231526 -0.173075
H -3.872213 2.107364 -2.187515


%chk=000251593-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251593

0 1
O -5.110140 0.696953 0.875941
O -3.873261 1.871474 -1.212206
O 5.900657 -0.038497 0.924174
C -1.791848 -0.978097 0.325161
C -2.647917 0.321960 0.232014
C -0.418575 -0.876753 -0.371401
C 0.374249 0.317362 0.255562
C 1.826603 0.502135 -0.354783
C -1.864146 1.477011 0.893701
C -0.454782 1.635628 0.261982
C -3.935321 -0.162003 0.979002
C -2.771001 -2.125775 -0.058505
C 0.386070 -2.186466 -0.218622
C -4.171048 -1.608754 0.422268
C 2.555670 -0.854289 -0.320966
C -2.994645 0.668487 -1.236867
C 1.796087 -2.060215 -0.842062
C 2.600705 1.543139 0.514742
C 1.775052 0.989642 -1.838266
C 4.127773 1.533985 0.296641
C 3.848734 -0.991218 0.118375
C 4.716977 0.139788 0.501464
H -1.572884 -1.097859 1.411282
H -0.568725 -0.693358 -1.457744
H 0.535037 0.036177 1.322946
H -1.761558 1.252678 1.975216
H -2.419555 2.428475 0.809248
H -0.559062 2.021544 -0.771054
H 0.091474 2.414386 0.825173
H -3.695107 -0.217295 2.060296
H -2.489703 -3.076844 0.426659
H -2.761553 -2.311213 -1.150508
H -0.154149 -3.026210 -0.695527
H 0.479123 -2.431108 0.859839
H -4.900993 -1.556258 -0.406228
H -4.615940 -2.257871 1.195649
H -3.531597 -0.168548 -1.724816
H -2.085911 0.899303 -1.823418
H 1.680515 -1.961776 -1.942999
H 2.384049 -2.980003 -0.669159
H 2.397378 1.327249 1.583408
H 2.210934 2.557604 0.311687
H 1.194413 0.305191 -2.481715
H 1.315850 1.991605 -1.904463
H 2.793103 1.056940 -2.261691
H 4.638118 2.237964 0.977595
H 4.377395 1.856442 -0.735205
H 4.319534 -1.982655 0.156189
H -4.970572 1.307123 0.094126
H -4.142704 2.113518 -2.132040


