%chk=000245261.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245261

0 1
O -0.315603 -1.401155 1.653442
N -4.333538 -0.335849 -0.664980
N -2.521625 1.166286 -0.717949
N 0.781021 1.329159 0.646524
N -2.274207 -0.896803 0.534684
N -0.510224 2.671151 -0.686394
C -4.720191 -1.748811 -1.003794
C -5.251922 -1.097997 0.249335
C -2.978203 -0.075653 -0.225948
C -0.437982 0.667286 0.472832
C -1.218833 1.524621 -0.352439
C 1.926173 0.792946 1.407637
C -0.936467 -0.622346 0.963001
C 0.707194 2.519860 -0.073716
C 2.859065 0.026852 0.500190
C 3.970011 0.660283 -0.073015
C 2.605801 -1.327121 0.238415
C 4.828645 -0.064902 -0.904285
C 3.467543 -2.045399 -0.594184
C 4.578822 -1.416237 -1.165354
H -3.983735 -2.557644 -0.925278
H -5.344019 -1.844160 -1.898493
H -6.273463 -0.706365 0.291889
H -4.898314 -1.438135 1.230480
H -3.092752 1.773877 -1.307115
H 1.529395 0.113022 2.212457
H 2.450222 1.627789 1.926264
H 1.509950 3.242883 -0.137794
H 4.169560 1.710926 0.124910
H 1.732542 -1.816532 0.685875
H 5.693241 0.424434 -1.349948
H 3.271059 -3.097621 -0.797653
H 5.249235 -1.978347 -1.813597


%chk=000245261-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245261

0 1
O -0.379581 -1.434848 1.690248
N -4.385471 -0.265738 -0.692740
N -2.548532 1.183040 -0.705241
N 0.725477 1.309383 0.639122
N -2.358994 -0.881258 0.517783
N -0.559350 2.684165 -0.669794
C -4.720003 -1.729490 -0.995593
C -5.250346 -1.091119 0.261779
C -3.035256 -0.031458 -0.243321
C -0.501161 0.651243 0.458921
C -1.254921 1.531011 -0.346229
C 1.906427 0.782392 1.381074
C -1.021581 -0.621005 0.952769
C 0.641164 2.506839 -0.055182
C 2.875253 0.008576 0.492589
C 4.000887 0.651625 -0.079363
C 2.652774 -1.368075 0.233710
C 4.891011 -0.066270 -0.909783
C 3.542568 -2.084762 -0.596844
C 4.661379 -1.436836 -1.171604
H -3.897503 -2.442772 -0.873242
H -5.365444 -1.857062 -1.869113
H -6.287384 -0.747969 0.314111
H -4.773126 -1.389401 1.201634
H -3.146969 1.777516 -1.283701
H 1.506333 0.129149 2.173517
H 2.407477 1.649380 1.846831
H 1.459360 3.221751 -0.093996
H 4.187889 1.713347 0.128569
H 1.787365 -1.864378 0.689423
H 5.760706 0.437896 -1.345668
H 3.366427 -3.148540 -0.791360
H 5.351524 -1.996034 -1.813304


