%chk=000253279.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253279

0 1
O -2.402425 0.434408 1.297927
O -2.830771 -1.854854 -0.489628
O 2.596789 2.225128 1.341556
O 1.326580 -2.188622 -1.516004
O 4.074069 -1.669212 -0.782543
O -3.269252 -1.873968 1.766558
N -1.165446 2.727814 -1.284455
N -0.218953 1.389835 1.040120
N -4.982076 -1.980791 0.190655
C -2.105898 1.984954 -0.386479
C -1.410837 3.260494 0.096935
C -1.451363 0.793932 0.334277
C -0.317837 2.884224 1.103643
C -0.890055 -0.381894 -0.537408
C 0.911755 0.767890 0.504882
C 0.600647 -0.306538 -0.286521
C -1.762788 3.467822 -2.414494
C -1.403534 -1.780865 -0.198627
C 2.343639 1.175216 0.795056
C 1.585871 -1.224253 -0.823300
C 3.353609 0.206431 0.319391
C 3.020115 -0.885376 -0.424871
C 4.768109 0.493138 0.693516
C -3.668394 -1.874871 0.615871
C 3.848707 -2.824097 -1.639997
H -3.174633 1.893239 -0.575150
H -1.925912 4.204138 0.271178
H 0.657725 3.373927 0.889893
H -0.625022 3.163578 2.135970
H -1.108851 -0.164241 -1.614490
H -1.873328 2.769974 -3.264156
H -1.047708 4.252230 -2.723212
H -2.737106 3.942744 -2.229774
H -2.074320 -0.251914 1.945189
H -1.205746 -2.078727 0.847530
H -0.975750 -2.534336 -0.896367
H 5.461080 0.227010 -0.119642
H 5.067054 -0.091513 1.576543
H 4.920256 1.556641 0.935071
H 4.871684 -3.201122 -1.757325
H 3.414354 -2.512922 -2.595315
H 3.200425 -3.548962 -1.136825
H -5.214400 -1.862693 -0.783399
H -5.721366 -1.827697 0.861721


%chk=000253279-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253279

0 1
O -2.570523 0.733881 1.266088
O -2.934160 -1.989235 -0.320227
O 2.547430 2.125324 1.623257
O 1.209653 -2.172471 -1.599261
O 4.003771 -1.606828 -0.936802
O -3.502123 -1.718785 1.950255
N -0.870308 2.791605 -1.293075
N -0.246802 1.469151 0.977191
N -5.052204 -2.463005 0.360000
C -1.971088 2.116800 -0.511934
C -1.293763 3.356935 0.048656
C -1.510868 0.909504 0.315607
C -0.359575 2.934312 1.188088
C -0.995396 -0.363522 -0.469082
C 0.851590 0.774267 0.545022
C 0.515017 -0.311959 -0.256366
C -1.304437 3.554391 -2.490949
C -1.499250 -1.743007 0.003263
C 2.276642 1.118115 0.879817
C 1.500443 -1.182044 -0.822631
C 3.308851 0.241296 0.315875
C 2.947283 -0.844813 -0.478969
C 4.757309 0.540810 0.624058
C -3.815300 -2.034481 0.763470
C 3.865304 -2.784828 -1.826481
H -3.004068 2.125964 -0.873550
H -1.814868 4.319330 0.092375
H 0.641034 3.390092 1.160469
H -0.830330 3.146038 2.164830
H -1.243172 -0.257564 -1.541045
H -1.352463 2.863122 -3.350443
H -0.546124 4.326802 -2.707133
H -2.295848 4.053292 -2.385425
H -2.599044 -0.163660 1.718415
H -1.341821 -1.897165 1.085647
H -0.950048 -2.507365 -0.568800
H 5.336434 0.703231 -0.303397
H 5.236046 -0.305894 1.149414
H 4.823458 1.440692 1.255451
H 4.906901 -3.107634 -1.980359
H 3.385166 -2.505963 -2.776825
H 3.267763 -3.574211 -1.344762
H -5.213285 -2.728982 -0.608687
H -5.804530 -2.496241 1.042457


