%chk=000241819.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241819

0 1
O -6.789194 -0.660786 0.536457
N 0.750227 1.301858 0.000922
N 1.928287 -0.786064 -0.081417
N 4.390968 -0.803945 0.045867
N 5.592418 1.183935 0.375201
N 3.145881 -2.809261 -0.068228
C -3.263741 -0.004270 -0.378144
C -4.695598 -0.434709 -0.502183
C -0.582538 0.797106 -0.136083
C -2.887474 1.309863 -0.695036
C -2.285740 -0.908275 0.063122
C -1.559486 1.715743 -0.579509
C -0.952860 -0.518354 0.189631
C -5.438575 -0.236755 0.822224
C 1.948835 0.582868 0.031221
C 3.158935 1.309157 0.165735
C 4.361288 0.570603 0.182342
C 3.159557 -1.423041 -0.043673
H -4.774067 -1.498186 -0.813308
H -5.222386 0.124104 -1.304806
H -3.637326 2.021719 -1.039032
H -2.566496 -1.931528 0.312878
H -1.286925 2.735616 -0.839618
H -0.206481 -1.239321 0.535252
H -5.455530 0.821226 1.136857
H -5.025493 -0.864883 1.630211
H 0.839955 2.320688 -0.000282
H 3.165529 2.381898 0.276538
H -7.335886 -0.606578 1.340743
H 5.682134 2.174044 0.231902
H 6.433282 0.635373 0.261513
H 4.014522 -3.299467 -0.221868
H 2.295279 -3.282080 -0.334427


%chk=000241819-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241819

0 1
O -6.856720 -0.742200 0.677960
N 0.775956 1.238162 -0.194582
N 1.968074 -0.819600 0.046428
N 4.415838 -0.802173 0.243465
N 5.630726 1.184992 0.197534
N 3.196626 -2.792022 0.286288
C -3.341627 0.082779 -0.473613
C -4.813542 -0.295291 -0.534184
C -0.567553 0.791282 -0.277499
C -2.930003 1.439562 -0.515110
C -2.332318 -0.902903 -0.332679
C -1.570655 1.792302 -0.419978
C -0.964616 -0.572945 -0.234925
C -5.441647 -0.377202 0.868849
C 1.979450 0.545345 -0.050601
C 3.187809 1.298181 -0.007369
C 4.395168 0.567901 0.142535
C 3.196332 -1.417330 0.189263
H -4.948993 -1.276631 -1.025296
H -5.388003 0.445242 -1.120990
H -3.682583 2.229287 -0.631497
H -2.621057 -1.961646 -0.307207
H -1.280675 2.851260 -0.461184
H -0.193677 -1.336822 -0.130551
H -5.348645 0.604212 1.381646
H -4.910683 -1.141242 1.476077
H 0.885297 2.252387 -0.252463
H 3.186812 2.389466 -0.086699
H -7.301049 -0.813815 1.559756
H 5.728962 2.193382 0.133677
H 6.452532 0.595096 0.305050
H 4.081907 -3.277877 0.394886
H 2.313858 -3.292840 0.254012


