%chk=000242114.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242114

0 1
O 5.101280 -1.227380 1.095066
O 0.047513 1.251613 0.625349
N 3.218520 0.385863 -0.305091
N 1.203768 1.173664 -1.388610
N -0.995278 0.270512 -1.210828
C 2.991766 0.013239 1.128378
C 4.683445 0.504781 -0.589168
C 3.692651 -1.325282 1.398829
C 5.344248 -0.849093 -0.273515
C 2.451162 1.609447 -0.692819
C 0.080082 0.902776 -0.544441
C -2.281982 0.011138 -0.632550
C -3.262769 -0.548176 -1.476483
C -2.576582 0.271712 0.717051
C -4.828438 -0.592075 0.383228
C -4.524969 -0.845722 -0.962600
C -3.842759 -0.031259 1.212707
C -6.179437 -0.908311 0.937519
H 1.893951 -0.077558 1.302457
H 3.364960 0.785268 1.835951
H 5.173084 1.306937 0.004588
H 4.822395 0.749634 -1.663036
H 3.699949 -1.584424 2.472065
H 3.254404 -2.147805 0.807277
H 4.973647 -1.648429 -0.939222
H 6.446123 -0.793534 -0.313433
H 3.018556 2.233304 -1.423844
H 2.172485 2.260938 0.173607
H 1.393639 0.498298 -2.136591
H -0.920761 0.094685 -2.214163
H -3.049144 -0.752267 -2.522423
H -1.820075 0.713386 1.375311
H -5.278864 -1.278734 -1.618454
H -4.067735 0.172419 2.259372
H -6.674600 -0.003413 1.318163
H -6.851011 -1.352819 0.192294
H -6.110724 -1.618933 1.773556


%chk=000242114-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242114

0 1
O 5.465903 -1.078898 1.130553
O -0.049425 1.464553 0.636257
N 3.419436 0.278139 -0.407593
N 1.178059 0.736851 -1.224483
N -1.088780 0.184753 -1.059759
C 3.092635 -0.391623 0.880653
C 4.822142 0.768779 -0.401482
C 4.069709 -1.552168 1.120067
C 5.774436 -0.412455 -0.144311
C 2.438300 1.325646 -0.776999
C 0.002643 0.837904 -0.465108
C -2.399601 0.009590 -0.531239
C -3.337923 -0.694326 -1.331223
C -2.802982 0.490601 0.743526
C -5.070050 -0.450542 0.404032
C -4.650516 -0.917019 -0.866709
C -4.119377 0.253331 1.188121
C -6.482236 -0.690457 0.910293
H 2.057579 -0.775345 0.835548
H 3.151110 0.326880 1.733761
H 4.989260 1.544988 0.385895
H 5.052833 1.222026 -1.385162
H 3.908012 -2.012284 2.108563
H 3.942058 -2.318425 0.324737
H 5.692036 -1.142061 -0.979251
H 6.818145 -0.068968 -0.052467
H 2.887778 1.923075 -1.593230
H 2.180031 2.006652 0.063589
H 1.242886 0.070701 -1.996862
H -0.948489 -0.195938 -1.998090
H -3.042002 -1.071662 -2.319480
H -2.087946 1.042098 1.356337
H -5.357197 -1.463116 -1.503150
H -4.414850 0.630263 2.175518
H -7.008403 0.262762 1.107865
H -7.082367 -1.258681 0.178529
H -6.480349 -1.261226 1.858247


