%chk=000291222.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291222

0 1
O -0.632805 -1.448874 0.850246
O -2.306167 -0.834678 -2.161350
O -2.665255 -2.097863 -0.440983
O 0.302233 -3.269543 -0.153617
N -2.034589 -1.258841 -1.054991
C 0.448095 -0.689236 -1.290173
C 0.673328 1.699179 -1.283144
C 0.299695 0.531613 -2.244173
C -0.769584 -0.656636 -0.329971
C 1.706522 -0.319528 -0.525645
C 1.846002 1.097852 -0.522800
C -0.467146 1.870090 -0.299548
C -1.144799 0.724253 0.177104
C 2.653120 -1.127857 0.073568
C 2.920769 1.704499 0.096864
C -0.839406 3.134557 0.166175
C -2.163948 0.859673 1.128284
C 3.752791 -0.508097 0.702728
C 3.881863 0.878350 0.717068
C -1.867392 3.261798 1.106741
C -2.524865 2.127891 1.591747
C -0.145020 -2.760873 0.839851
C -0.290485 -3.287319 2.219340
H 0.529317 -1.665026 -1.814839
H 0.922454 2.633358 -1.818504
H -0.711598 0.628407 -2.676517
H 0.999729 0.461407 -3.091955
H 2.562165 -2.213382 0.055378
H 3.033939 2.785009 0.111379
H -0.327481 4.023261 -0.199525
H -2.670510 -0.031338 1.508901
H 4.509535 -1.129397 1.179313
H 4.737063 1.339203 1.209435
H -2.153894 4.251259 1.463731
H -3.319726 2.229556 2.329174
H -1.205647 -3.901710 2.299880
H -0.378895 -2.484607 2.971746
H 0.563292 -3.926707 2.493380


%chk=000291222-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291222

0 1
O -0.544386 -1.414602 0.926801
O -2.119868 -1.222666 -2.293855
O -2.890347 -1.912529 -0.270343
O -0.120622 -3.406270 -0.236860
N -2.030096 -1.334856 -1.023439
C 0.449609 -0.649580 -1.294941
C 0.690047 1.739920 -1.262491
C 0.330757 0.585397 -2.243368
C -0.753916 -0.641704 -0.302465
C 1.731273 -0.295299 -0.530683
C 1.880778 1.116534 -0.515389
C -0.487334 1.907319 -0.300947
C -1.182575 0.751316 0.158818
C 2.682380 -1.127729 0.082842
C 2.973934 1.718083 0.128727
C -0.893252 3.177600 0.164853
C -2.251282 0.881802 1.076844
C 3.797938 -0.525903 0.720678
C 3.940045 0.881675 0.746827
C -1.966339 3.308633 1.073442
C -2.645785 2.156652 1.532848
C -0.256171 -2.799567 0.843359
C -0.163702 -3.373442 2.233779
H 0.489348 -1.617348 -1.813642
H 0.931427 2.695294 -1.756796
H -0.663235 0.691896 -2.702558
H 1.090890 0.495604 -3.039527
H 2.581053 -2.218539 0.050959
H 3.091079 2.807489 0.148977
H -0.363993 4.069418 -0.190812
H -2.766975 -0.015996 1.431801
H 4.561469 -1.155794 1.190765
H 4.809619 1.328795 1.241650
H -2.272323 4.301941 1.420071
H -3.476861 2.251517 2.239470
H -1.164446 -3.360750 2.701274
H 0.500969 -2.756059 2.860999
H 0.203595 -4.408549 2.186630


