%chk=000289456.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289456

0 1
O 3.391685 -0.752141 -2.044646
N 1.515898 0.729015 -0.634873
N 2.799778 0.524588 -0.186357
C -4.197723 0.071367 0.326414
C -5.596430 0.245204 -0.280744
C -3.153117 0.907131 -0.425570
C -6.641829 -0.590047 0.470780
C -1.755821 0.733297 0.183453
C -8.040292 -0.415939 -0.136339
C -0.713451 1.569546 -0.572444
C -9.087343 -1.251042 0.614163
C 0.655579 1.426798 0.052311
C -10.481263 -1.081586 0.013812
C 0.884135 2.097347 1.374661
C 3.683458 -0.249929 -0.987883
C 5.033369 -0.360484 -0.331024
C 5.399570 -1.566292 0.278402
C 5.925723 0.717166 -0.375424
C 6.666691 -1.688551 0.856479
C 7.192057 0.587014 0.202120
C 7.560954 -0.613405 0.819095
H -4.213179 0.358448 1.395282
H -3.909411 -0.997721 0.305278
H -5.581271 -0.044967 -1.349273
H -5.885204 1.313701 -0.263194
H -3.136506 0.613945 -1.493857
H -3.443371 1.975158 -0.410768
H -6.656897 -0.301722 1.539417
H -6.353784 -1.658933 0.451033
H -1.460382 -0.335142 0.154384
H -1.770795 1.014724 1.253402
H -8.026761 -0.704881 -1.204901
H -8.329999 0.652178 -0.118545
H -0.685272 1.252602 -1.640248
H -1.000358 2.639726 -0.586774
H -9.103403 -0.962102 1.683220
H -8.799841 -2.320547 0.594420
H -10.813127 -0.037871 0.051944
H -11.221273 -1.681337 0.555225
H -10.509279 -1.395497 -1.035878
H 1.149651 1.372674 2.156527
H -0.012491 2.624608 1.730338
H 1.684242 2.847724 1.315300
H 3.119783 0.899996 0.711843
H 4.704016 -2.406332 0.292586
H 5.639309 1.646806 -0.867261
H 6.958521 -2.624695 1.330688
H 7.893162 1.419630 0.166728
H 8.549093 -0.712629 1.267396


%chk=000289456-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289456

0 1
O 3.574471 -1.223225 -1.813507
N 1.575252 0.466706 -0.775547
N 2.859402 0.371147 -0.238616
C -4.290055 0.077677 0.340627
C -5.691736 0.185455 -0.301678
C -3.182356 0.743542 -0.506208
C -6.807292 -0.468713 0.544319
C -1.776174 0.622964 0.123262
C -8.205199 -0.369877 -0.107256
C -0.683283 1.301703 -0.748957
C -9.324390 -1.016834 0.740409
C 0.703003 1.227493 -0.143051
C -10.715611 -0.918351 0.077688
C 0.994233 2.010280 1.131695
C 3.820823 -0.459521 -0.841651
C 5.186583 -0.383303 -0.200120
C 6.033013 -1.513406 -0.337886
C 5.670106 0.764881 0.482823
C 7.327073 -1.509541 0.221865
C 6.968873 0.769837 1.038496
C 7.797384 -0.369483 0.916757
H -4.312272 0.542030 1.349032
H -4.039804 -0.992405 0.496419
H -5.669912 -0.286332 -1.306328
H -5.937574 1.255562 -0.467088
H -3.168445 0.286038 -1.517031
H -3.427906 1.816507 -0.653605
H -6.835645 0.008581 1.546509
H -6.558520 -1.536999 0.716352
H -1.516427 -0.446016 0.254072
H -1.790786 1.073823 1.137401
H -8.179007 -0.852702 -1.106733
H -8.453073 0.697763 -0.285372
H -0.650290 0.816097 -1.740398
H -0.962753 2.365422 -0.903078
H -9.352628 -0.531293 1.737463
H -9.074151 -2.082304 0.921239
H -11.001142 0.137701 -0.088794
H -11.498195 -1.385539 0.703620
H -10.721951 -1.425288 -0.905821
H 1.245307 1.341962 1.980463
H 0.117818 2.606132 1.430360
H 1.842318 2.712278 0.995250
H 3.105844 0.845631 0.639106
H 5.655340 -2.376107 -0.896468
H 5.063214 1.676767 0.545167
H 7.970275 -2.389783 0.114807
H 7.338532 1.663966 1.552538
H 8.804513 -0.364323 1.348152


