%chk=000245287.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245287

0 1
O -0.415286 1.998220 -0.457373
N -0.252421 -0.492595 1.240784
N 2.006643 -1.041911 1.334526
N 3.589487 -0.431318 -0.449817
N 0.591971 1.596251 -0.965957
N 2.896806 0.792223 -2.303130
N 4.294617 -1.588763 1.480908
C -1.484318 -0.189581 0.538587
C 1.000936 -0.333910 0.696144
C -1.735129 -0.775416 -0.712916
C -2.440298 0.639783 1.150441
C -3.917513 0.295328 -0.750516
C -0.405283 -1.247409 2.515828
C 1.298031 0.504565 -0.444724
C -2.950523 -0.525860 -1.351503
C -3.651686 0.874801 0.502449
C 2.594200 0.294223 -1.058734
C -5.212074 0.571891 -1.442536
C 3.266121 -1.000376 0.773510
H -0.984810 -1.406686 -1.187417
H -2.224766 1.114659 2.106628
H 0.255804 -0.818108 3.291762
H -0.112446 -2.305292 2.382637
H -1.445629 -1.207069 2.870962
H -3.143506 -0.970361 -2.326619
H -4.391138 1.525526 0.966835
H -5.168655 1.538316 -1.968797
H -5.462692 -0.191292 -2.190677
H -6.055078 0.623095 -0.740578
H 3.843086 0.735091 -2.651507
H 2.274019 1.450168 -2.752807
H 4.084351 -2.140956 2.297883
H 5.189678 -1.724039 1.035724


%chk=000245287-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245287

0 1
O -0.308922 2.200397 -0.286987
N -0.220012 -0.275151 1.324484
N 1.960638 -1.108821 1.260700
N 3.541780 -0.590324 -0.553857
N 0.753415 1.753576 -0.896830
N 2.983202 0.997329 -2.178333
N 4.102104 -2.023509 1.195466
C -1.446882 -0.063754 0.588455
C 1.022758 -0.271058 0.714236
C -1.635666 -0.684870 -0.669361
C -2.513291 0.664765 1.168318
C -3.941228 0.181930 -0.782922
C -0.338666 -0.938703 2.648902
C 1.359541 0.581832 -0.417212
C -2.866040 -0.548566 -1.346856
C -3.740992 0.778864 0.490956
C 2.644905 0.304632 -1.052850
C -5.255292 0.348976 -1.524801
C 3.167127 -1.201233 0.618501
H -0.826193 -1.274978 -1.112659
H -2.362459 1.178183 2.123742
H 0.506367 -0.647241 3.290054
H -0.327373 -2.039596 2.546162
H -1.288823 -0.627593 3.108662
H -2.995681 -1.031221 -2.323221
H -4.552994 1.358779 0.946367
H -5.294310 1.325908 -2.045215
H -5.393280 -0.436277 -2.288618
H -6.119005 0.312099 -0.836607
H 3.906008 0.864879 -2.585937
H 2.339297 1.728850 -2.488166
H 3.867249 -2.516801 2.052726
H 5.005218 -2.138106 0.742699


