%chk=000288739.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288739

0 1
O -0.987967 -2.232615 -0.975970
O -0.715390 2.715095 -0.706657
O -4.731362 -0.715922 0.861823
O -2.262187 -2.774030 0.699570
O 2.451371 1.083543 -1.276060
O 5.107533 -1.620546 1.483671
N 0.908904 -0.099382 -0.078981
N 4.513030 0.260323 0.345119
C -0.156629 0.081831 -1.091574
C -0.387801 -1.242698 -1.860406
C -1.443291 0.518116 -0.426862
C -2.382071 -0.460829 0.004885
C -1.266157 -1.068993 -3.084990
C -1.723688 1.876565 -0.271751
C -1.936689 -1.870958 -0.039399
C -3.617319 -0.021463 0.496077
C 2.165296 0.474440 -0.257901
C 3.152141 0.284841 0.917676
C -2.945937 2.312696 0.297036
C -3.882054 1.375364 0.663453
C 2.974877 1.448996 1.892586
C -1.009521 4.129059 -0.802034
C 5.416439 -0.756193 0.681292
C -4.846861 -2.145087 0.653978
C 6.747955 -0.670149 -0.007059
H 0.183823 0.881226 -1.823932
H 0.576110 -1.752365 -2.105201
H 0.666936 -0.639452 0.747020
H -0.746191 -0.521210 -3.880749
H -2.195894 -0.529658 -2.862836
H -1.555339 -2.048497 -3.493415
H 2.974157 -0.693413 1.453322
H -3.143913 3.374418 0.437329
H -4.846194 1.662856 1.088548
H 3.684461 1.366493 2.727859
H 1.964912 1.468042 2.319108
H 3.150019 2.420909 1.412927
H 4.719745 0.973966 -0.352224
H -1.174827 4.550867 0.192970
H -0.075840 4.513048 -1.238756
H -1.854803 4.305301 -1.472214
H -4.580650 -2.418394 -0.368989
H -4.222576 -2.675800 1.388893
H -5.914996 -2.304803 0.848475
H 7.392739 -1.502310 0.322144
H 6.658762 -0.745431 -1.099308
H 7.280536 0.261402 0.224611


%chk=000288739-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288739

0 1
O -1.065654 -2.360862 -0.770889
O -0.627626 2.663959 -0.620966
O -4.849084 -0.725162 0.935291
O -2.613976 -2.784588 0.837385
O 2.526980 0.399737 -1.603344
O 5.633963 -0.572566 2.054320
N 0.885501 -0.137225 -0.051836
N 4.542055 0.113155 0.126533
C -0.213999 -0.045570 -1.038923
C -0.462240 -1.393212 -1.747502
C -1.490593 0.453049 -0.385641
C -2.485312 -0.486649 0.035673
C -1.328780 -1.291188 -3.008997
C -1.678135 1.841015 -0.186715
C -2.114253 -1.936646 0.061304
C -3.721238 0.005951 0.572411
C 2.187082 0.128148 -0.405337
C 3.213897 0.106886 0.746393
C -2.867560 2.313257 0.423695
C -3.872222 1.400872 0.779111
C 3.012908 1.314984 1.703602
C -0.785985 4.113363 -0.467312
C 5.677889 -0.245159 0.825925
C -5.239447 -1.959463 0.228326
C 6.972327 -0.216891 0.013947
H 0.128464 0.682069 -1.796736
H 0.506341 -1.861306 -1.987020
H 0.659396 -0.396207 0.910497
H -0.788601 -0.722728 -3.787357
H -2.289547 -0.785139 -2.812360
H -1.535307 -2.301263 -3.401056
H 3.106209 -0.824360 1.338316
H -3.028878 3.380769 0.597388
H -4.816849 1.744530 1.210546
H 3.795801 1.280440 2.478485
H 2.025945 1.277653 2.199893
H 3.091356 2.265087 1.147142
H 4.555563 0.338380 -0.875503
H -0.881793 4.395647 0.598829
H 0.135401 4.545132 -0.883568
H -1.662165 4.484289 -1.033333
H -4.944346 -1.912327 -0.837581
H -4.770736 -2.834505 0.702628
H -6.336616 -1.993863 0.315798
H 7.804405 -0.523185 0.664346
H 6.917571 -0.906967 -0.847921
H 7.175487 0.797858 -0.374785


