%chk=000245653.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245653

0 1
O 3.450439 -1.888643 -0.077591
N -0.886410 -0.141532 0.032713
N 1.047863 1.496415 0.074909
N 0.352657 -2.073559 -0.012795
N 3.220423 0.391615 -0.003262
N 3.068837 2.768925 -0.132613
C -2.073912 0.745766 0.064239
C -2.979457 0.407063 1.273305
C -2.928356 0.561992 -1.215012
C -4.231473 -0.279564 0.708548
C -4.341150 0.158797 -0.761653
C 0.461381 0.222886 0.017943
C -0.890705 -1.576805 0.010193
C 1.216028 -0.979317 -0.008613
C 2.689433 -0.960736 -0.038731
C 2.489416 1.476060 -0.007039
H -1.714430 1.801306 0.142087
H -3.249892 1.335152 1.808547
H -2.466820 -0.228965 2.017215
H -2.498214 -0.207240 -1.884209
H -2.948824 1.491451 -1.808416
H -5.134666 -0.008751 1.280864
H -4.140327 -1.378506 0.782098
H -4.750366 -0.648715 -1.392411
H -5.038477 1.009922 -0.862095
H -1.812814 -2.138201 0.011847
H 0.513345 2.322129 -0.177097
H 2.766507 3.454281 0.552203
H 4.091063 2.743575 -0.193774


%chk=000245653-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245653

0 1
O 3.533894 -1.892526 -0.123359
N -0.839325 -0.228279 0.233564
N 1.018517 1.435154 -0.027066
N 0.438029 -2.133988 0.205263
N 3.225522 0.439791 -0.144375
N 2.970268 2.766405 -0.238141
C -2.040329 0.641769 0.240050
C -3.103737 0.205804 1.306370
C -2.793249 0.627739 -1.138327
C -4.296669 -0.364094 0.497366
C -4.298464 0.503882 -0.786092
C 0.485500 0.156534 0.083827
C -0.805466 -1.644005 0.292649
C 1.273951 -1.008069 0.072150
C 2.740116 -0.916992 -0.071414
C 2.431084 1.493370 -0.130963
H -1.682649 1.661913 0.478066
H -3.434423 1.098723 1.868028
H -2.680742 -0.501899 2.038918
H -2.463682 -0.259477 -1.709255
H -2.564338 1.516980 -1.751611
H -5.247396 -0.313089 1.055254
H -4.121045 -1.425112 0.233938
H -4.885635 0.061493 -1.609221
H -4.729706 1.499430 -0.564693
H -1.709826 -2.237022 0.401288
H 0.433107 2.265262 -0.130360
H 2.444785 3.617194 -0.055578
H 3.983009 2.809909 -0.324874


