%chk=000259320.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259320

0 1
O -0.248843 -0.922696 0.500491
O -4.091529 0.777814 0.293850
O -4.709065 -1.162592 1.223356
N -0.531331 2.338156 -0.725478
N -1.896595 -0.157191 -0.882097
N 6.118552 -1.083460 0.561137
C 1.593304 1.132236 -0.042122
C 2.517224 -0.031568 -0.424199
C 0.257064 1.078815 -0.808964
C 3.868272 0.068564 0.292424
C 4.792357 -1.097651 -0.107816
C -0.628731 -0.071524 -0.284459
C -2.854045 -1.153286 -0.379834
C -3.962745 -0.579020 0.477157
H 2.098786 2.095655 -0.243372
H 1.401791 1.102107 1.050630
H 2.670676 -0.057703 -1.519530
H 2.019737 -0.991167 -0.156241
H 0.460490 0.872179 -1.897353
H 4.354020 1.034006 0.057347
H 3.710456 0.065146 1.388477
H 4.964746 -1.092244 -1.207094
H 4.302355 -2.070913 0.121165
H -0.057294 3.091420 -1.216609
H -0.648563 2.634731 0.240716
H -2.309961 0.674862 -1.318789
H -2.311578 -1.940331 0.220302
H -3.318746 -1.687437 -1.247248
H 6.015870 -1.157000 1.568662
H 6.608742 -0.214164 0.375747
H -4.818416 1.171457 0.849044


%chk=000259320-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259320

0 1
O -0.248332 -1.361498 -0.174941
O -3.590612 0.730324 1.264755
O -5.028058 -1.078629 1.027752
N -0.576832 2.168705 -1.121559
N -2.026715 0.002585 -0.827891
N 6.159354 -0.922872 0.860371
C 1.508486 1.006137 -0.184452
C 2.575860 -0.068063 -0.496735
C 0.230600 0.916735 -1.066907
C 3.839543 0.073548 0.381441
C 4.926008 -0.985180 0.047912
C -0.687239 -0.261854 -0.636810
C -3.056307 -0.940281 -0.436696
C -3.995629 -0.472235 0.671260
H 1.951638 2.012159 -0.339054
H 1.218438 0.938299 0.883655
H 2.865510 0.006814 -1.567454
H 2.124525 -1.066271 -0.354811
H 0.547383 0.695348 -2.107042
H 4.276450 1.088452 0.260247
H 3.559682 -0.023957 1.451541
H 5.213666 -0.889697 -1.017790
H 4.492400 -1.997565 0.161371
H -0.223445 2.850706 -1.800295
H -0.698452 2.600270 -0.196225
H -2.218711 0.970170 -1.132728
H -2.541415 -1.856108 -0.081601
H -3.695602 -1.241676 -1.288379
H 6.010985 -1.135447 1.852563
H 6.690287 -0.053537 0.740926
H -4.236469 0.961821 1.986871


