%chk=000243448.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243448

0 1
O 4.592118 -0.956845 0.270380
O -1.628133 1.275334 0.333481
O 2.567124 -4.309677 0.468901
O -4.545899 3.155852 -0.157945
O -2.583707 3.699203 0.594238
N 1.387882 -2.327501 0.396127
N 0.193045 -1.789778 0.120850
N 0.701969 -4.303780 -0.869059
N -3.391746 2.905277 0.151542
C 2.986759 0.858957 0.590447
C 3.202416 -0.593289 0.144842
C 3.386840 1.858724 -0.499911
C 2.514747 -1.621857 1.069872
C 3.200290 3.307653 -0.027215
C 3.605502 4.306700 -1.107570
C 1.598235 -3.728625 0.020657
C -0.107912 -0.543112 0.392896
C -1.445489 -0.089536 0.070219
C -2.606443 -0.651916 -0.432839
C -2.962626 1.530603 -0.033395
C -3.582242 0.388510 -0.499878
H 3.565152 1.051841 1.517250
H 1.919627 1.018567 0.867376
H 2.917747 -0.746159 -0.921580
H 4.440932 1.698168 -0.799097
H 2.784932 1.686279 -1.414345
H 3.290334 -2.389789 1.365670
H 2.164858 -1.170684 2.021348
H 3.795104 3.487290 0.889985
H 2.143331 3.478818 0.260291
H 3.463753 5.338307 -0.763037
H 3.007293 4.185220 -2.018195
H 4.659061 4.198903 -1.388793
H 5.173312 -0.245187 -0.063649
H 0.553954 0.226319 0.839756
H -0.161828 -3.854962 -1.137405
H 0.767580 -5.301064 -1.026829
H -2.752242 -1.678231 -0.718171
H -4.600527 0.298169 -0.846015


%chk=000243448-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243448

0 1
O 3.130291 -0.688067 -1.104629
O -2.644601 0.819763 0.190722
O 2.870911 -3.597791 0.748672
O -6.021727 1.803072 -0.512184
O -4.253208 3.005803 0.347288
N 1.182421 -1.971985 0.516409
N -0.120627 -1.785247 0.164256
N 0.849835 -4.174358 -0.284548
N -4.786040 1.920921 -0.117870
C 3.506879 1.127552 0.587500
C 2.522527 0.109253 -0.028471
C 3.987048 2.198744 -0.417996
C 2.082769 -0.922214 1.034810
C 4.908845 3.259140 0.227079
C 5.402037 4.317466 -0.782203
C 1.716856 -3.309684 0.334863
C -0.717028 -0.613491 0.341931
C -2.103975 -0.469838 -0.017739
C -3.099448 -1.312093 -0.545769
C -3.981717 0.744451 -0.219663
C -4.291563 -0.537068 -0.674328
H 4.380434 0.579999 0.993337
H 3.009975 1.633537 1.441427
H 1.647408 0.667250 -0.431296
H 4.542549 1.715544 -1.250505
H 3.108876 2.705784 -0.870889
H 2.973747 -1.460067 1.398848
H 1.601096 -0.407211 1.888770
H 5.778496 2.751225 0.690544
H 4.363518 3.759626 1.052990
H 6.051108 5.066605 -0.293686
H 4.551744 4.856339 -1.240925
H 5.983716 3.849482 -1.598682
H 3.456734 -0.078976 -1.813802
H -0.233797 0.279138 0.763120
H -0.071250 -3.845823 -0.570814
H 1.157761 -5.129934 -0.438551
H -2.965107 -2.359922 -0.801033
H -5.262389 -0.854228 -1.045779


