%chk=000244306.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244306

0 1
O 0.232197 2.063355 -0.939823
O -2.647858 1.282394 -0.645845
N 0.504025 0.361669 0.610474
N -2.889661 -2.524267 -0.202270
C 1.981811 0.320356 0.668837
C -0.296579 -0.702755 1.273236
C 2.591644 -0.705160 -0.322033
C -1.768072 -0.427949 0.862310
C -0.218032 1.177561 -0.254553
C -1.712603 0.768254 -0.118708
C 2.641205 -0.129181 -1.738204
C 3.992811 -1.099921 0.156226
C -2.393509 -1.591124 0.262625
H 2.285981 0.090330 1.713089
H 2.361069 1.346271 0.439960
H -0.169011 -0.639654 2.375454
H 0.042739 -1.714594 0.958608
H 1.951637 -1.622478 -0.333981
H -2.369944 -0.107683 1.759311
H 3.354668 0.699717 -1.820194
H 2.938981 -0.887779 -2.469901
H 1.666826 0.268514 -2.052171
H 4.660148 -0.233101 0.227947
H 4.461371 -1.802003 -0.544999
H 3.971658 -1.587574 1.136002


%chk=000244306-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244306

0 1
O 0.358322 2.378140 -0.464048
O -2.547686 1.534251 -0.652283
N 0.519071 0.235895 0.545822
N -3.556989 -2.135481 -0.145128
C 1.975178 0.222238 0.748714
C -0.322289 -0.936909 0.856839
C 2.733303 -0.791947 -0.153810
C -1.780572 -0.386849 0.773021
C -0.146487 1.303516 -0.047574
C -1.638249 0.914724 -0.081253
C 2.464431 -0.527582 -1.652141
C 4.243189 -0.713379 0.171164
C -2.762871 -1.348478 0.270282
H 2.183399 -0.001110 1.815017
H 2.327798 1.248180 0.533638
H -0.082724 -1.332382 1.859658
H -0.169549 -1.747712 0.119879
H 2.382408 -1.816315 0.095483
H -2.098605 -0.044954 1.779756
H 2.788059 0.491333 -1.934665
H 3.016840 -1.249670 -2.280018
H 1.391369 -0.615671 -1.903000
H 4.644388 0.287662 -0.076051
H 4.808017 -1.456393 -0.419512
H 4.443751 -0.907911 1.241608


