%chk=000228201.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228201

0 1
O -2.483929 -1.403266 2.077397
O -3.317673 -1.507474 -2.457007
O 0.462081 -0.987091 -0.023875
O 3.333255 0.850998 0.512389
N -2.847711 -1.768483 -0.192554
C -3.513221 0.349059 0.680342
C -3.790275 0.316331 -0.865815
C -2.512573 1.543487 0.834521
C -2.908271 1.491097 -1.407460
C -1.660762 1.398455 -0.469114
C -3.327453 2.792403 0.476567
C -3.560552 2.762088 -0.849112
C -2.876208 -0.994923 1.011753
C -3.307353 -1.047501 -1.343263
C -2.168854 -3.083480 -0.292048
C -0.684362 -2.936231 -0.651791
C 0.156570 -2.322210 0.465637
C 1.284325 -0.210828 0.880481
C 1.993285 0.796599 -0.027934
C 6.386223 0.213957 0.028185
C 5.592699 1.473939 0.433338
C 4.264158 1.605490 -0.308122
C 7.499573 -0.057690 1.048417
C 6.975604 0.356024 -1.381009
H -4.427473 0.501108 1.284897
H -4.858029 0.456181 -1.121014
H -1.972043 1.563381 1.784715
H -2.725608 1.463181 -2.485293
H -0.944394 2.214678 -0.616120
H -1.091958 0.455265 -0.541216
H -3.626222 3.510529 1.212662
H -4.097878 3.449124 -1.470476
H -2.690608 -3.681757 -1.076123
H -2.292561 -3.614046 0.680310
H -0.278122 -3.925926 -0.936668
H -0.575936 -2.302791 -1.564346
H -0.388840 -2.231991 1.424284
H 1.105200 -2.863402 0.621248
H 2.023275 -0.849407 1.400974
H 0.616307 0.262694 1.618401
H 5.680213 -0.655394 0.035062
H 1.548885 1.803706 0.016424
H 2.013546 0.436877 -1.074126
H 6.203910 2.381083 0.275987
H 5.376672 1.436393 1.523853
H 3.918639 2.652187 -0.358298
H 4.286716 1.171384 -1.322122
H 7.090857 -0.223647 2.051092
H 8.073914 -0.950565 0.778945
H 8.205377 0.776860 1.112651
H 7.510609 -0.552279 -1.678730
H 6.194199 0.533591 -2.127079
H 7.685978 1.187035 -1.441819


%chk=000228201-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228201

0 1
O -1.885543 -0.896958 2.192906
O -3.958259 -1.484329 -1.968797
O 0.294659 -1.788055 -0.153209
O 3.287509 0.220990 0.567653
N -2.868072 -1.485000 0.124624
C -2.853326 0.840059 0.669956
C -3.555656 0.645073 -0.712444
C -1.619230 1.774339 0.314231
C -2.647077 1.490290 -1.703277
C -1.235154 1.218922 -1.094782
C -2.239941 3.123473 -0.077462
C -2.854108 2.953929 -1.285301
C -2.454858 -0.568245 1.123554
C -3.508700 -0.861939 -0.974295
C -2.690655 -2.943468 0.218657
C -1.434998 -3.489254 -0.500097
C -0.098052 -3.166966 0.176471
C 1.545876 -1.421980 0.526053
C 1.946298 -0.030054 0.038998
C 6.233560 0.705327 0.229242
C 5.195256 1.705315 0.805121
C 3.781084 1.565667 0.231934
C 7.562480 0.812704 1.013404
C 6.477211 0.922804 -1.283231
H -3.485616 1.302078 1.445265
H -4.603552 0.984592 -0.747350
H -0.845229 1.788161 1.095035
H -2.808077 1.243934 -2.762293
H -0.454441 1.826848 -1.580941
H -0.931334 0.157902 -1.088761
H -2.251576 4.012700 0.558371
H -3.465507 3.677626 -1.830742
H -3.590278 -3.400223 -0.231590
H -2.655420 -3.194862 1.294353
H -1.542099 -4.591400 -0.538778
H -1.412884 -3.133816 -1.546415
H -0.177601 -3.280051 1.280221
H 0.691059 -3.861065 -0.190252
H 2.350888 -2.143771 0.268277
H 1.400932 -1.426869 1.626011
H 5.821459 -0.313176 0.372164
H 1.231803 0.736012 0.407498
H 1.947260 -0.004186 -1.072823
H 5.544497 2.743429 0.622198
H 5.134299 1.573029 1.903353
H 3.104114 2.330394 0.675340
H 3.772614 1.702632 -0.872474
H 7.409128 0.620757 2.092047
H 8.305792 0.083156 0.641094
H 8.002367 1.824324 0.908549
H 7.234277 0.212043 -1.663693
H 5.556880 0.773886 -1.876894
H 6.849142 1.948069 -1.478678


