%chk=000236108.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236108

0 1
O 0.611642 2.105541 -0.011798
O -1.106951 -2.176213 0.017371
N 0.071570 -0.168782 0.003544
C 1.454518 -0.753944 0.004191
C -1.733376 1.387916 -0.004080
C -2.309803 -0.032592 0.006236
C -0.217099 1.230112 -0.004797
C -1.111651 -0.970792 0.009697
C 2.196511 -0.308078 1.264646
C 2.188209 -0.329699 -1.268604
H 1.322952 -1.872532 0.014240
H -2.054185 1.980575 0.874152
H -2.056231 1.968524 -0.889664
H -2.951269 -0.235098 -0.873296
H -2.947622 -0.223789 0.890943
H 3.201951 -0.741808 1.302448
H 2.312197 0.785922 1.299300
H 1.670959 -0.611304 2.176926
H 1.656913 -0.648940 -2.172050
H 3.193554 -0.763791 -1.305406
H 2.303410 0.763470 -1.322798


%chk=000236108-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236108

0 1
O 0.613019 2.170121 -0.017909
O -1.073978 -2.209473 0.020608
N 0.067493 -0.137151 0.002132
C 1.444079 -0.712688 0.003058
C -1.764631 1.397771 -0.004922
C -2.323745 -0.041370 0.007890
C -0.235698 1.246785 -0.008166
C -1.093405 -0.956252 0.011192
C 2.204989 -0.307990 1.284416
C 2.198782 -0.326516 -1.287691
H 1.273601 -1.805183 0.011322
H -2.060931 1.990141 0.877879
H -2.065964 1.976154 -0.895281
H -2.942065 -0.279489 -0.874742
H -2.936385 -0.265762 0.898065
H 3.192336 -0.804689 1.296574
H 2.362616 0.783574 1.321436
H 1.652151 -0.621466 2.188539
H 1.641660 -0.653075 -2.184520
H 3.186176 -0.823169 -1.297483
H 2.356099 0.764426 -1.341195


