%chk=000240751.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240751

0 1
O 2.723036 1.600211 0.774919
O 3.921198 -1.908821 -1.623989
N -2.829154 1.104190 0.406394
N 0.935207 0.464267 1.594691
N 4.679182 -0.305346 -0.200794
N 0.988623 1.147368 2.845918
N 5.649130 -1.146305 0.405008
C -0.946735 0.780052 -0.845430
C 0.361399 0.976457 -1.516324
C 1.500704 0.202781 -0.812263
C -1.610814 1.682012 -0.012627
C -1.771587 -0.396521 -0.962247
C -2.950418 -0.173965 -0.172816
C 2.771659 0.223233 -1.672942
C -1.185825 3.020532 0.447003
C -1.629771 -1.615012 -1.653484
C 1.783127 0.845178 0.545002
C -3.969487 -1.142467 -0.071148
C -3.811477 1.740750 1.290036
C -2.632923 -2.562429 -1.548278
C 3.802561 -0.775356 -1.182678
C -3.792394 -2.326964 -0.763684
H 0.617759 2.054822 -1.580979
H 0.285629 0.629010 -2.571185
H 1.174906 -0.862318 -0.667947
H 2.522118 -0.040408 -2.724891
H 3.195160 1.251239 -1.709513
H -0.278911 3.358956 -0.079132
H -1.957392 3.785664 0.277914
H -0.945445 3.019273 1.523898
H -0.743235 -1.795055 -2.257627
H -4.856115 -0.959861 0.526198
H -3.321005 2.147211 2.193722
H -4.330748 2.567830 0.772082
H -4.573477 1.012949 1.620095
H -2.544110 -3.511781 -2.073446
H -4.554049 -3.104101 -0.714111
H -0.009027 0.092164 1.409143
H 4.519216 0.569896 0.326259
H 1.507978 2.035463 2.744237
H 1.556556 0.575590 3.490543
H 5.246698 -2.078531 0.586208
H 6.412751 -1.307459 -0.268336


%chk=000240751-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240751

0 1
O 2.911356 1.507942 0.878843
O 3.957169 -1.984438 -1.717603
N -2.908224 1.133043 0.383436
N 0.966771 0.509808 1.632064
N 4.799564 -0.345812 -0.291822
N 1.032949 1.187671 2.891337
N 5.782957 -1.209007 0.280125
C -0.964634 0.797992 -0.793320
C 0.390895 0.984243 -1.425237
C 1.564526 0.180196 -0.740885
C -1.671226 1.708373 0.011478
C -1.799970 -0.384225 -0.932465
C -3.007056 -0.144130 -0.187901
C 2.822776 0.205747 -1.647936
C -1.263839 3.072614 0.490832
C -1.645783 -1.619686 -1.615360
C 1.888058 0.772154 0.640295
C -4.050067 -1.092792 -0.112225
C -3.948115 1.743842 1.212371
C -2.682146 -2.572195 -1.542396
C 3.900460 -0.805170 -1.239719
C -3.870523 -2.312363 -0.798784
H 0.674557 2.053377 -1.457640
H 0.350862 0.640305 -2.477533
H 1.226209 -0.867316 -0.617002
H 2.521549 -0.063462 -2.674939
H 3.235414 1.230775 -1.655849
H -0.322501 3.377718 0.005860
H -2.021797 3.843595 0.255474
H -1.088704 3.088336 1.584616
H -0.740190 -1.832461 -2.195395
H -4.969072 -0.898422 0.451287
H -3.579315 2.687302 1.641549
H -4.857519 1.959532 0.620053
H -4.223160 1.072595 2.046433
H -2.577203 -3.529345 -2.064944
H -4.658584 -3.072713 -0.762161
H 0.039890 0.154767 1.375270
H 4.572406 0.508925 0.235836
H 1.670294 1.993606 2.779113
H 1.397291 0.549096 3.614223
H 5.410353 -2.171647 0.300516
H 6.643820 -1.183973 -0.286494


