%chk=000242967.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242967

0 1
O 1.608698 1.150640 -1.424902
O 0.298709 1.164134 2.054229
O 1.249271 -2.882519 0.058177
N -0.075420 -1.074647 -0.715357
N 0.880371 -0.981636 1.383449
C -0.363164 0.306382 -0.198354
C 0.265564 1.445385 -1.049052
C -1.858739 0.556671 -0.075596
C 0.276556 0.285300 1.229961
C 0.767043 -1.785326 0.189642
C 0.155099 -1.276317 -2.164298
C -2.804889 -0.290525 -0.664838
C -2.292193 1.686578 0.640512
C 2.648274 1.599871 -0.508171
C 3.683134 0.476519 -0.518140
C -4.169677 -0.000572 -0.555859
C -3.654055 1.971055 0.746087
C 4.905586 0.843040 0.331666
C -4.596928 1.130271 0.143554
C 5.942893 -0.276660 0.327501
H 0.189976 2.411748 -0.519133
H -0.249897 1.522815 -2.028378
H 1.335352 -1.309067 2.230992
H -0.732085 -0.942851 -2.726366
H 0.305308 -2.355419 -2.356975
H 1.042025 -0.726673 -2.536723
H -2.491902 -1.188990 -1.198964
H -1.565551 2.333352 1.139508
H 2.243791 1.798357 0.496929
H 3.035324 2.538535 -0.943025
H 3.986288 0.261948 -1.563031
H 3.226037 -0.464364 -0.153488
H -4.899746 -0.664990 -1.016361
H -3.982691 2.847060 1.304042
H 4.592526 1.057303 1.373050
H 5.364454 1.777832 -0.047083
H -5.659235 1.354302 0.225926
H 5.530732 -1.212583 0.723688
H 6.309245 -0.486179 -0.684328
H 6.811216 -0.014981 0.942907


%chk=000242967-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242967

0 1
O 1.778099 0.363518 -0.163838
O -0.414031 0.104729 2.570204
O 0.181844 -3.542619 -0.348629
N -0.385552 -1.263550 -0.747513
N -0.171295 -1.943626 1.393255
C -0.596367 -0.043689 0.061364
C 0.482397 1.029698 -0.228821
C -2.018376 0.535923 -0.075095
C -0.384628 -0.577957 1.520634
C -0.092922 -2.378130 0.030266
C -0.146901 -1.250209 -2.191270
C -3.029415 -0.180888 -0.761757
C -2.348358 1.773376 0.536681
C 2.905655 1.311347 -0.175644
C 4.202460 0.498864 -0.146446
C -4.338155 0.341198 -0.860980
C -3.657200 2.293090 0.437439
C 5.459711 1.399915 -0.146372
C -4.656243 1.583539 -0.267523
C 6.768810 0.581751 -0.125837
H 0.411775 1.825132 0.540694
H 0.315773 1.484067 -1.229901
H 0.006947 -2.580503 2.169571
H -0.972276 -0.742908 -2.720575
H -0.085150 -2.296350 -2.532736
H 0.808772 -0.745097 -2.426534
H -2.794094 -1.154982 -1.202746
H -1.600310 2.316708 1.122535
H 2.835293 1.979726 0.711227
H 2.855785 1.943959 -1.090912
H 4.222270 -0.177424 -1.022840
H 4.199198 -0.145018 0.753905
H -5.108613 -0.225393 -1.395686
H -3.898902 3.246665 0.919785
H 5.431474 2.074005 0.733875
H 5.447187 2.053960 -1.042360
H -5.671654 1.987990 -0.342872
H 6.819282 -0.061195 0.772654
H 6.839000 -0.075655 -1.012553
H 7.656011 1.240832 -0.121250


