%chk=000210800.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210800

0 1
O -2.822365 -0.536567 2.423257
O -2.204376 0.048103 -2.261090
N 1.437089 -0.005035 0.518863
N 4.279583 -0.087353 -0.030475
C -2.380804 0.374743 0.175072
C -0.900021 0.731186 0.400050
C 0.023517 -0.499051 0.445472
C 1.972832 0.305067 -0.847214
C 2.326367 -1.009418 1.188898
C -2.859086 -0.665120 1.228565
C -2.543995 -0.364937 -1.183913
C 3.388577 0.900310 -0.716381
C 3.744260 -0.418245 1.326957
C -3.209270 1.644439 0.232150
C -3.344928 -1.871028 0.486729
C -3.163524 -1.697636 -0.904389
C 5.685704 0.092508 -0.159083
C -3.467118 2.382666 -0.933014
C -3.680879 2.123180 1.464853
C -3.906215 -3.031049 0.994466
C -3.541155 -2.682578 -1.802155
C -4.292105 -4.034792 0.083791
C -4.112875 -3.863797 -1.288827
C -4.214599 3.561582 -0.868919
C -4.427500 3.302220 1.523925
C 6.223110 0.778238 -1.274573
C 6.576209 -0.517222 0.756391
C -4.701711 4.022579 0.357425
C 7.602123 0.838518 -1.462424
C 7.952154 -0.444876 0.549603
C 8.476970 0.233107 -0.554859
H -0.795730 1.302946 1.347996
H -0.574677 1.430285 -0.399970
H -0.159058 -1.166423 -0.423867
H -0.204760 -1.096628 1.356203
H 1.303715 1.054065 -1.324948
H 1.999704 -0.584726 -1.514321
H 2.375302 -1.977887 0.644814
H 1.921067 -1.214257 2.203594
H 3.787919 1.117769 -1.733111
H 3.346070 1.864038 -0.160629
H 3.717243 0.480546 1.983719
H 4.406016 -1.169458 1.814812
H -3.077858 2.051170 -1.899401
H -3.460617 1.582541 2.390076
H -4.046552 -3.161871 2.068401
H -3.400864 -2.545974 -2.875369
H -4.737585 -4.955715 0.462959
H -4.418567 -4.651537 -1.978995
H -4.413603 4.123444 -1.780583
H -4.793201 3.661202 2.485137
H 5.562546 1.249087 -1.999660
H 6.192201 -1.058168 1.618554
H -5.285841 4.939380 0.404917
H 8.001876 1.366476 -2.328079
H 8.626014 -0.922472 1.260696
H 9.550072 0.287724 -0.706794


%chk=000210800-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000210800

0 1
O -2.694720 -0.639318 2.499259
O -2.034313 -0.199646 -2.260756
N 1.538296 -0.049859 0.547685
N 4.389751 0.026254 0.025475
C -2.328480 0.267164 0.186728
C -0.845434 0.689196 0.415818
C 0.129168 -0.502831 0.536986
C 2.061175 0.277890 -0.799993
C 2.457454 -1.000503 1.217373
C -2.843015 -0.742553 1.252897
C -2.507993 -0.525787 -1.139736
C 3.464029 0.906308 -0.714246
C 3.857643 -0.379124 1.347343
C -3.215614 1.545883 0.184264
C -3.513603 -1.872189 0.545213
C -3.315815 -1.747150 -0.853278
C 5.788696 0.158677 -0.165666
C -3.458664 2.258040 -1.018832
C -3.714945 2.070993 1.404848
C -4.231262 -2.958039 1.086852
C -3.830160 -2.704773 -1.751263
C -4.755840 -3.917053 0.190165
C -4.557256 -3.791686 -1.213819
C -4.198620 3.461599 -1.000978
C -4.454471 3.274349 1.417500
C 6.339463 1.175973 -1.004888
C 6.702413 -0.755393 0.446335
C -4.702847 3.974525 0.215233
C 7.730515 1.258416 -1.229001
C 8.089111 -0.655876 0.222807
C 8.622513 0.348798 -0.619628
H -0.787389 1.299477 1.333894
H -0.562417 1.337055 -0.433768
H -0.057814 -1.237749 -0.288355
H -0.066445 -1.028095 1.490272
H 1.382144 0.993113 -1.296444
H 2.115907 -0.639455 -1.440130
H 2.537240 -1.964628 0.653099
H 2.067186 -1.221668 2.227910
H 3.838524 1.041651 -1.743325
H 3.386803 1.909785 -0.234602
H 3.789138 0.506828 2.019477
H 4.532679 -1.109177 1.819128
H -3.064059 1.880632 -1.967324
H -3.519474 1.545283 2.344941
H -4.371470 -3.045315 2.168823
H -3.665250 -2.599900 -2.828143
H -5.321762 -4.771926 0.576061
H -4.973938 -4.552440 -1.882901
H -4.377158 3.998522 -1.939513
H -4.832636 3.664913 2.369042
H 5.690637 1.923784 -1.469577
H 6.329264 -1.568884 1.076558
H -5.277235 4.907569 0.226635
H 8.117493 2.053608 -1.877399
H 8.758371 -1.379700 0.702970
H 9.701290 0.419731 -0.792726


