%chk=000270801.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270801

0 1
O -2.683768 -1.796325 -0.449201
O 0.920760 1.085457 0.778792
O 5.411197 1.651832 -0.938605
N 3.398553 0.103412 0.364915
C -3.179752 0.618185 -0.047832
C -3.733679 -0.780848 -0.133300
C -1.858904 0.866703 0.098930
C -4.211263 1.710974 -0.121439
C -1.307943 2.261280 0.210344
C -3.695993 3.037746 0.453640
C -2.318158 3.362166 -0.131878
C -0.908557 -0.249008 0.151168
C -1.384877 -1.541308 -0.167842
C -4.306092 -1.250371 1.204723
C -4.689884 -1.002425 -1.303882
C 0.468823 -0.153826 0.459122
C 1.336206 -1.276355 0.438018
C 2.764414 -1.152999 0.898306
C -0.541568 -2.662419 -0.253489
C 0.814383 -2.527012 0.046698
C 3.576311 0.041519 -1.123688
C 4.715555 0.371880 1.031363
C 1.671100 -3.751801 -0.034132
C 4.160967 1.376744 -1.605361
C 5.272134 1.701093 0.494412
H -4.505260 1.853489 -1.182861
H -5.131580 1.409809 0.416986
H -0.922740 2.398060 1.246108
H -0.412101 2.362385 -0.440666
H -4.411042 3.850977 0.236182
H -3.628451 2.967807 1.556465
H -1.956341 4.334704 0.248750
H -2.395490 3.470166 -1.231169
H -4.542332 -2.320829 1.178025
H -3.581531 -1.097780 2.015104
H -5.216660 -0.704905 1.469069
H -4.290230 -0.565984 -2.227805
H -4.825486 -2.076563 -1.492362
H -5.674520 -0.565927 -1.115237
H 2.775264 -1.095266 2.012690
H 3.346134 -2.065795 0.623895
H -0.968468 -3.618683 -0.540021
H 2.579871 -0.134925 -1.588294
H 4.233761 -0.796923 -1.438327
H 5.454198 -0.440686 0.858994
H 4.553687 0.443917 2.127719
H 4.462515 1.342481 -2.667264
H 3.467943 2.218847 -1.432651
H 4.627918 2.556101 0.765279
H 6.309288 1.883003 0.827722
H 2.747489 -3.524003 -0.051484
H 1.487612 -4.409029 0.829166
H 1.449352 -4.339454 -0.936708
H 1.958334 1.130711 0.821515


%chk=000270801-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270801

0 1
O -2.754965 -1.734873 -0.699748
O 1.015684 0.967807 0.851043
O 5.444524 1.825562 -0.576928
N 3.376946 0.060425 0.445427
C -3.194861 0.643559 -0.094234
C -3.734565 -0.790996 -0.044078
C -1.839842 0.873377 -0.027028
C -4.231148 1.757795 -0.137937
C -1.273746 2.291443 -0.102230
C -3.637942 3.146997 0.179267
C -2.309678 3.329328 -0.581020
C -0.915013 -0.285308 0.035991
C -1.408522 -1.563860 -0.357337
C -3.932735 -1.256263 1.420351
C -5.008871 -1.008533 -0.879179
C 0.467628 -0.229206 0.389780
C 1.320504 -1.377962 0.295240
C 2.748312 -1.261117 0.812668
C -0.578385 -2.694006 -0.493347
C 0.795659 -2.613213 -0.175013
C 3.654412 0.168013 -1.021142
C 4.611726 0.342506 1.234151
C 1.660077 -3.859962 -0.300559
C 4.212763 1.562111 -1.342072
C 5.163046 1.730173 0.863629
H -4.712615 1.781458 -1.139041
H -5.049602 1.531060 0.577429
H -0.873943 2.576176 0.889274
H -0.392648 2.292929 -0.769391
H -4.365328 3.937758 -0.086461
H -3.445378 3.230397 1.267687
H -1.908025 4.350160 -0.432744
H -2.494224 3.206913 -1.667884
H -4.315039 -2.292566 1.446926
H -2.976830 -1.212690 1.970635
H -4.656341 -0.598914 1.936408
H -4.848601 -0.691547 -1.923686
H -5.261189 -2.082905 -0.877970
H -5.862951 -0.449593 -0.460962
H 2.752019 -1.296441 1.922454
H 3.378863 -2.099996 0.452866
H -1.025627 -3.633851 -0.829833
H 2.711513 -0.008156 -1.569249
H 4.390534 -0.609003 -1.327467
H 5.385770 -0.432960 1.034362
H 4.359384 0.313578 2.310711
H 4.501045 1.637625 -2.402752
H 3.450699 2.337368 -1.109903
H 4.432426 2.515097 1.157843
H 6.124921 1.918285 1.367609
H 2.521915 -3.700183 -0.977289
H 2.068342 -4.185080 0.675662
H 1.070882 -4.698324 -0.707812
H 2.070123 0.849607 0.785484


