%chk=000222753.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222753

0 1
O -0.705157 0.413242 0.197969
N -4.312912 -0.077754 -0.065130
C 1.718852 -0.562781 1.007344
C 1.611201 0.744599 0.250842
C -2.911497 -0.326974 0.393063
C -2.058876 0.815076 -0.181609
C 2.718815 -1.478754 0.325587
C 0.342412 1.238080 -0.150633
C -5.315344 -0.345628 1.017887
C -4.619549 -0.857027 -1.311877
C 2.035815 -0.294910 2.483673
C 2.734682 1.508532 -0.064013
C 0.204197 2.449626 -0.835411
C 2.294033 -2.216146 -0.793663
C 4.043685 -1.605920 0.764229
C -5.240202 0.747478 2.084434
C -5.811543 -0.230514 -2.036541
C 2.613463 2.725644 -0.750782
C 1.355539 3.189931 -1.131090
C 3.179033 -3.069420 -1.454709
C 4.927385 -2.463646 0.100812
C 4.498976 -3.197733 -1.007924
H 0.713883 -1.074895 0.975163
H -2.836606 -0.316655 1.502589
H -2.495457 -1.307238 0.076285
H -2.292822 1.787182 0.281593
H -2.116737 0.884663 -1.279668
H -6.329226 -0.334053 0.556061
H -5.189790 -1.347035 1.483061
H -3.728568 -0.816878 -1.978148
H -4.815461 -1.932269 -1.109742
H 2.954426 0.288343 2.610154
H 2.150230 -1.231301 3.040501
H 1.224921 0.276674 2.951924
H 3.724080 1.149012 0.223113
H -0.767619 2.823265 -1.138490
H 1.270499 -2.114405 -1.151443
H 4.394134 -1.039352 1.624570
H -4.300030 0.712837 2.646506
H -5.301892 1.744609 1.627260
H -6.062765 0.654580 2.800760
H -5.665958 0.850661 -2.167955
H -5.946816 -0.675247 -3.027672
H -6.746332 -0.359184 -1.479120
H 3.504394 3.301790 -0.986013
H 1.259945 4.135187 -1.664035
H 2.841646 -3.635503 -2.320929
H 5.953596 -2.557391 0.451165
H 5.187018 -3.863898 -1.522446


%chk=000222753-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222753

0 1
O -0.779726 0.252635 0.095938
N -4.506706 0.020071 0.103028
C 1.746831 -0.804724 0.662902
C 1.596447 0.521073 -0.101286
C -3.098974 -0.333749 0.412278
C -2.150327 0.724258 -0.167557
C 3.014747 -1.570621 0.264622
C 0.294284 1.047070 -0.354413
C -5.451030 -0.286537 1.210302
C -4.951088 -0.510836 -1.215548
C 1.616956 -0.538076 2.186880
C 2.708538 1.283338 -0.523151
C 0.120397 2.287340 -1.013827
C 3.086889 -2.156087 -1.028683
C 4.127009 -1.725648 1.128944
C -5.338275 0.705095 2.383749
C -6.095318 0.307974 -1.842886
C 2.550877 2.528093 -1.177326
C 1.254166 3.026333 -1.422312
C 4.228066 -2.873529 -1.444644
C 5.275349 -2.443710 0.717363
C 5.331884 -3.020851 -0.570217
H 0.877146 -1.430151 0.380142
H -2.955050 -0.369787 1.506284
H -2.813776 -1.337099 0.018572
H -2.325495 1.701408 0.323240
H -2.304383 0.842253 -1.259819
H -6.476172 -0.230564 0.801766
H -5.316127 -1.333213 1.584038
H -4.081991 -0.480841 -1.899463
H -5.252054 -1.586654 -1.139252
H 2.400779 0.153523 2.545828
H 1.687084 -1.479446 2.762480
H 0.637468 -0.076261 2.397221
H 3.713833 0.885289 -0.345547
H -0.880495 2.683706 -1.207698
H 2.237089 -2.039910 -1.713112
H 4.102231 -1.291693 2.134095
H -4.331731 0.690575 2.840313
H -5.537881 1.732542 2.032854
H -6.067434 0.451685 3.175908
H -5.786443 1.360577 -1.966455
H -6.364377 -0.102642 -2.833994
H -7.006363 0.292669 -1.217768
H 3.431547 3.096657 -1.494484
H 1.116424 3.987101 -1.931101
H 4.258202 -3.318824 -2.445852
H 6.123026 -2.552418 1.404024
H 6.219652 -3.578893 -0.888874


