%chk=000211542.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211542

0 1
O 6.929229 -1.075406 0.409056
O 0.050974 -2.284937 -0.557901
N 4.118852 -0.905596 -0.054934
N 0.496023 -0.049103 -0.622934
N 0.155350 1.246137 -0.519699
C 2.673805 -0.816433 0.322031
C 4.888351 0.276927 0.453475
C 4.739613 -2.176882 0.440851
C 1.939338 -0.303551 -0.936123
C 6.339272 0.161436 -0.040729
C 6.195812 -2.230088 -0.049040
C -0.402672 -1.163261 -0.428442
C -1.788219 -0.773105 -0.101002
C -1.107854 1.558259 -0.237042
C -2.119914 0.546053 -0.023050
C -2.771772 -1.847000 0.132029
C -1.459266 2.994154 -0.145757
C -2.773699 -3.000886 -0.670014
C -3.722245 -1.715785 1.159953
C -2.141819 3.471493 0.984931
C -1.117732 3.873447 -1.184525
C -3.727554 -3.998680 -0.457734
C -4.670984 -2.719576 1.367919
C -2.487180 4.822338 1.066708
C -1.468086 5.223519 -1.093989
C -4.679069 -3.859518 0.557722
C -2.153688 5.698730 0.028116
H 2.479569 -0.149567 1.187810
H 2.261257 -1.813915 0.599733
H 4.875471 0.358473 1.561917
H 4.421924 1.200331 0.048931
H 4.169050 -3.032430 0.018029
H 4.710999 -2.271239 1.547518
H 1.988912 -1.069253 -1.746102
H 2.412833 0.625871 -1.324958
H 6.401982 0.209757 -1.142157
H 6.998375 0.919413 0.416775
H 6.758685 -3.064143 0.404711
H 6.254962 -2.278848 -1.150732
H -3.141665 0.870944 0.187767
H -2.016045 -3.125071 -1.447153
H -3.715009 -0.839048 1.804441
H -2.392083 2.794807 1.799886
H -0.576036 3.503100 -2.054882
H -3.724986 -4.890140 -1.083734
H -5.404485 -2.614363 2.165662
H -3.015366 5.194454 1.943414
H -1.203870 5.906203 -1.900563
H -5.420812 -4.639242 0.720686
H -2.425828 6.750721 0.095321


%chk=000211542-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211542

0 1
O 7.023137 -0.900519 0.205296
O 0.069539 -2.405855 -0.617177
N 4.134096 -0.931017 -0.075353
N 0.468456 -0.107837 -0.639074
N 0.155209 1.216900 -0.480393
C 2.709364 -0.759484 0.273710
C 4.895490 0.344047 -0.097276
C 4.836208 -1.942634 0.755611
C 1.885701 -0.374244 -0.981576
C 6.320601 0.096055 -0.619725
C 6.258692 -2.160321 0.214356
C -0.401161 -1.232834 -0.456898
C -1.786384 -0.874171 -0.089643
C -1.120697 1.514636 -0.141781
C -2.099119 0.479021 0.039558
C -2.806846 -1.931646 0.127857
C -1.439999 2.961695 0.007024
C -2.733423 -3.192812 -0.531138
C -3.911587 -1.688742 0.996380
C -2.608451 3.396323 0.690075
C -0.564387 3.944496 -0.532433
C -3.746252 -4.157880 -0.347696
C -4.917246 -2.657439 1.182579
C -2.896969 4.771758 0.822402
C -0.852552 5.316928 -0.397882
C -4.843095 -3.897614 0.504916
C -2.022592 5.739306 0.277943
H 2.555825 0.015780 1.063752
H 2.316190 -1.716873 0.658627
H 4.952776 0.797032 0.924742
H 4.386866 1.069550 -0.759490
H 4.276266 -2.895129 0.710058
H 4.899853 -1.626506 1.827038
H 1.923653 -1.209059 -1.697894
H 2.273961 0.545181 -1.445299
H 6.273466 -0.255728 -1.673021
H 6.931871 1.011801 -0.559710
H 6.830873 -2.847700 0.859017
H 6.202547 -2.570541 -0.816994
H -3.134492 0.767470 0.239608
H -1.876318 -3.409750 -1.171887
H -3.967149 -0.750303 1.560022
H -3.290854 2.668814 1.142780
H 0.336811 3.610941 -1.055046
H -3.673985 -5.118852 -0.868799
H -5.750478 -2.452611 1.863899
H -3.800598 5.087074 1.355646
H -0.168742 6.059425 -0.824067
H -5.623230 -4.653161 0.650158
H -2.248146 6.806533 0.379392


