%chk=000255877.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255877

0 1
O -0.711031 2.556297 -1.379719
O -0.380956 -1.436029 -1.092959
N -1.683672 2.586170 0.724157
N -1.958047 -2.975979 -0.370735
N 0.672829 2.347302 0.484647
N 0.189992 -2.873623 0.651989
C -3.666652 1.172570 0.170290
C -3.661060 -1.166129 -0.476260
C -3.071555 0.103862 -0.512056
C -3.039786 2.545032 0.115065
C -2.998369 -2.312534 -1.203370
C -4.853559 0.968015 0.888082
C -4.849295 -1.368497 0.239121
C -5.441798 -0.299693 0.917203
C -0.578419 2.472298 -0.171909
C -0.684424 -2.331644 -0.325206
C 1.935839 2.322483 -0.189770
C 1.557900 -2.480040 0.826428
C 3.087594 2.580816 0.582791
C 2.048037 2.018679 -1.558167
C 2.337599 -3.258467 1.708187
C 2.109410 -1.355604 0.190119
C 4.342240 2.533838 -0.027153
C 3.312607 1.975728 -2.144101
C 3.664626 -2.896654 1.944327
C 3.439236 -1.016005 0.440473
C 4.461793 2.230675 -1.386589
C 4.220456 -1.778566 1.315264
H -2.141481 0.257156 -1.075916
H -3.657322 3.302294 0.652184
H -2.979828 2.890128 -0.951548
H -3.734518 -3.093858 -1.500019
H -2.523776 -1.951799 -2.152302
H -5.323471 1.793715 1.419505
H -5.315751 -2.351058 0.263886
H -6.367268 -0.454522 1.470250
H -1.628379 2.118602 1.628776
H -2.326057 -3.377778 0.491799
H 0.712972 2.431887 1.501105
H -0.089010 -3.723547 1.145589
H 3.009967 2.819123 1.639576
H 1.151883 1.825870 -2.158473
H 1.921616 -4.131922 2.201024
H 1.511778 -0.752145 -0.503521
H 5.233926 2.738436 0.564558
H 3.402375 1.740325 -3.205095
H 4.270547 -3.494871 2.624053
H 3.867926 -0.141647 -0.055913
H 5.441751 2.198306 -1.855386
H 5.255387 -1.504694 1.501915


%chk=000255877-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255877

0 1
O -0.795063 3.591770 -1.231832
O -0.338840 -1.865279 -0.981850
N -1.430395 2.134027 0.480562
N -2.050437 -3.121099 -0.001472
N 0.823677 2.261187 -0.125080
N 0.113081 -3.223493 0.899219
C -3.653170 1.041581 0.216660
C -3.780836 -1.345140 -0.391118
C -3.065174 -0.123765 -0.325737
C -2.866988 2.349632 0.285454
C -3.079929 -2.593562 -0.925263
C -4.990928 0.981073 0.684557
C -5.120114 -1.387266 0.066600
C -5.723394 -0.223091 0.598161
C -0.481323 2.727225 -0.358040
C -0.728008 -2.679071 -0.087581
C 2.035778 2.737614 -0.694633
C 1.480771 -2.913927 1.143328
C 3.240839 2.110585 -0.271550
C 2.091814 3.793757 -1.643963
C 2.094391 -3.530797 2.269103
C 2.243333 -2.033798 0.326700
C 4.482883 2.533127 -0.786028
C 3.345293 4.205458 -2.146038
C 3.445486 -3.273926 2.576571
C 3.595414 -1.786003 0.652075
C 4.545858 3.586501 -1.728117
C 4.207710 -2.396278 1.770406
H -2.036050 -0.092244 -0.701154
H -3.284418 2.993111 1.086451
H -2.957322 2.922132 -0.658025
H -3.811211 -3.398655 -1.120840
H -2.556469 -2.364083 -1.869284
H -5.459296 1.875918 1.113529
H -5.690272 -2.323353 0.009627
H -6.759575 -0.257505 0.953100
H -1.139785 1.517467 1.240566
H -2.377298 -3.603090 0.838005
H 0.925083 1.442331 0.479501
H -0.285620 -3.935141 1.515364
H 3.201979 1.296026 0.463990
H 1.163614 4.262754 -1.975000
H 1.511911 -4.211814 2.904167
H 1.778849 -1.579824 -0.550602
H 5.402034 2.041366 -0.447188
H 3.378825 5.020561 -2.878163
H 3.901570 -3.760083 3.446127
H 4.177479 -1.117718 0.006518
H 5.510625 3.915810 -2.128363
H 5.258418 -2.198707 2.006774


