%chk=000278195.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278195

0 1
O 2.138468 0.515776 0.962525
O 3.197533 1.564091 -1.867568
O 4.190476 -0.668903 -1.343850
O 3.370725 -2.037889 2.418376
O -0.161804 3.458284 0.856850
O -4.305230 -0.096563 0.221899
N 0.160463 1.303213 -0.068609
N -1.988069 1.980319 0.482352
N -0.383730 -1.017747 -0.816552
N -2.757304 -1.568410 -0.628761
N -1.145818 -3.085413 -1.626539
C 1.637878 1.305469 -0.117320
C 2.163127 0.674765 -1.433500
C 2.808070 -0.681464 -1.020612
C 2.543520 -0.810539 0.499943
C 3.766883 -1.187061 1.339205
C -0.705055 0.222594 -0.302000
C -0.625071 2.391807 0.540076
C -2.010555 0.607986 0.072632
C -3.138375 -0.258477 -0.061997
C -2.994528 2.507542 1.420841
C -1.432506 -1.870494 -0.989377
C -3.847820 -2.543935 -0.873653
H 2.007770 2.348077 0.076149
H 1.393222 0.571600 -2.223716
H 2.413498 -1.548539 -1.590288
H 1.685814 -1.489864 0.707944
H 4.279794 -0.289201 1.730874
H 4.480548 -1.814334 0.764701
H 3.520711 1.287294 -2.758349
H 4.604038 0.187419 -1.046681
H -2.847183 2.155460 2.455527
H -4.003355 2.188847 1.086870
H -2.952064 3.612631 1.411846
H 2.850035 -1.527311 3.076150
H -4.823342 -2.081832 -0.596466
H -3.728703 -3.444169 -0.250810
H -3.909769 -2.819372 -1.939772
H -1.713718 -3.893633 -1.414449
H -0.159973 -3.298222 -1.761793


%chk=000278195-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278195

0 1
O 2.154403 0.172808 1.062153
O 2.832730 1.750892 -1.996821
O 4.567090 0.138496 -0.868205
O 3.253950 -1.975148 2.590492
O -0.058152 3.334654 1.031580
O -4.397237 -0.025626 0.219542
N 0.155446 1.125330 0.085362
N -1.912849 1.858264 0.648884
N -0.435106 -1.125719 -0.732484
N -2.806565 -1.597109 -0.595064
N -1.249897 -3.199746 -1.423962
C 1.618319 1.082101 0.045323
C 2.180219 0.612760 -1.329765
C 3.249596 -0.474199 -0.981294
C 2.772354 -1.011671 0.378589
C 3.852486 -1.537932 1.322668
C -0.745327 0.098558 -0.204588
C -0.558879 2.247305 0.645991
C -2.031735 0.550095 0.135957
C -3.179359 -0.281983 -0.039051
C -2.988677 2.723375 1.142308
C -1.493911 -1.944651 -0.904960
C -3.914615 -2.551018 -0.803735
H 1.955776 2.105517 0.283058
H 1.380631 0.179978 -1.953519
H 3.274280 -1.274554 -1.748353
H 1.978374 -1.770070 0.228211
H 4.617868 -0.754958 1.474276
H 4.332457 -2.435264 0.897708
H 2.528132 1.834063 -2.931700
H 4.516687 1.003791 -1.365158
H -3.525263 2.241157 1.975982
H -3.714065 2.942750 0.341171
H -2.522134 3.659179 1.489921
H 2.770452 -1.196333 2.969379
H -4.835320 -2.034267 -0.489545
H -3.783553 -3.455542 -0.181537
H -4.005902 -2.828677 -1.869965
H -1.975934 -3.896108 -1.554333
H -0.278171 -3.440696 -1.602416


