%chk=000252549.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252549

0 1
O -0.147597 2.382983 0.091835
N -0.448536 0.111495 0.201480
N 2.360231 0.724442 -1.179602
C -1.947020 0.224654 0.143520
C 0.149766 -1.261875 0.171902
C -2.470610 1.008841 1.364716
C -2.406193 0.890665 -1.169908
C -0.501550 -2.157953 1.248369
C 0.008542 -1.880404 -1.234903
C -4.001827 1.082222 1.322605
C -3.937219 0.962490 -1.212829
C 0.115960 -3.561230 1.210177
C 0.613865 -3.288768 -1.261016
C -4.492574 1.708965 0.009144
C -0.009475 -4.189143 -0.185169
C 0.331282 1.258971 0.085025
C 1.840681 1.096111 0.019499
C 2.629566 1.405146 1.139883
C 4.019614 1.326415 1.010563
C 3.712224 0.660044 -1.286967
C 4.574847 0.950439 -0.215735
H -2.359855 -0.820680 0.181286
H 1.242186 -1.177457 0.416802
H -2.040640 2.034739 1.357558
H -2.128015 0.539116 2.302316
H -2.015447 0.339787 -2.042786
H -1.977094 1.914888 -1.238439
H -1.596549 -2.224121 1.083732
H -0.371948 -1.705101 2.248410
H 0.515921 -1.230406 -1.977011
H -1.053672 -1.917391 -1.538841
H -4.368223 1.676358 2.180951
H -4.435102 0.071383 1.442809
H -4.365500 -0.056493 -1.259527
H -4.258238 1.472115 -2.141013
H -0.379540 -4.206387 1.960054
H 1.181708 -3.513975 1.506326
H 1.709726 -3.229618 -1.114106
H 0.466372 -3.738413 -2.261128
H -5.597228 1.712723 -0.019181
H -4.177973 2.770730 -0.033168
H 0.476521 -5.182344 -0.196572
H -1.076453 -4.367543 -0.420179
H 2.165795 1.713367 2.075476
H 4.663261 1.561966 1.858325
H 4.100315 0.365906 -2.269322
H 5.652796 0.887339 -0.344065


%chk=000252549-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252549

0 1
O -0.061171 2.341339 0.495732
N -0.412104 0.055460 0.144082
N 2.477000 0.222505 -0.775057
C -1.899242 0.253226 0.068231
C 0.092987 -1.352355 0.093671
C -2.511971 0.788303 1.390009
C -2.313815 1.126133 -1.145081
C -0.480395 -2.222014 1.244921
C -0.150323 -2.004040 -1.290644
C -4.053302 0.876545 1.274074
C -3.855899 1.213246 -1.246627
C 0.118463 -3.650092 1.190568
C 0.431903 -3.437783 -1.331449
C -4.478281 1.746285 0.066429
C -0.129574 -4.312500 -0.185391
C 0.400853 1.164558 0.280962
C 1.915201 1.049660 0.163823
C 2.690743 1.937222 0.954356
C 4.091150 1.955453 0.791670
C 3.831333 0.270584 -0.938094
C 4.677766 1.109039 -0.178826
H -2.320676 -0.756563 -0.103380
H 1.185066 -1.304050 0.230710
H -2.088063 1.786339 1.597049
H -2.225815 0.122658 2.227186
H -1.889169 0.692099 -2.070919
H -1.886991 2.137197 -1.023742
H -1.583837 -2.296206 1.165809
H -0.254474 -1.743346 2.217389
H 0.325249 -1.372186 -2.062163
H -1.237596 -2.046962 -1.507243
H -4.473935 1.288838 2.211687
H -4.478601 -0.143051 1.154548
H -4.275095 0.207769 -1.464891
H -4.135323 1.865543 -2.096544
H -0.314874 -4.267807 2.000793
H 1.211108 -3.597486 1.377373
H 1.536409 -3.381252 -1.240377
H 0.216281 -3.902912 -2.312691
H -5.582421 1.773213 -0.016490
H -4.139057 2.788963 0.232084
H 0.329346 -5.319800 -0.211924
H -1.220963 -4.452578 -0.331542
H 2.177045 2.603374 1.652385
H 4.711877 2.622962 1.398538
H 4.241361 -0.390618 -1.710295
H 5.758927 1.100086 -0.349411


