%chk=000235438.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235438

0 1
O 1.433958 1.945071 -0.726077
N 2.429929 -0.082991 -1.261361
N 4.745741 -0.602383 0.447528
N 0.159712 0.021511 -0.458627
C 2.683704 -1.419332 -0.649640
C 3.716709 0.662677 -1.431111
C 3.441812 -1.305095 0.689384
C 4.506105 0.770003 -0.111520
C 1.347673 0.728856 -0.770702
C 5.529632 -0.515746 1.715245
C -1.081024 0.619515 -0.075667
C -2.220919 -0.262342 0.088139
C -3.451939 0.306910 0.508127
C -1.205161 1.975194 0.160594
C -2.167518 -1.670860 -0.154689
C -3.546621 1.712661 0.750665
C -2.448845 2.517051 0.576103
C -4.593520 -0.541902 0.682479
C -3.275274 -2.462932 0.017714
C -4.507398 -1.889736 0.444619
H 3.297835 -1.998128 -1.382260
H 1.737942 -1.981117 -0.515556
H 3.502704 1.680458 -1.831714
H 4.308565 0.115377 -2.198964
H 2.805626 -0.804254 1.450254
H 3.667925 -2.323083 1.074225
H 5.495955 1.233547 -0.313855
H 3.970823 1.445125 0.591996
H 5.046151 0.049964 2.525387
H 6.504208 -0.047097 1.500280
H 5.739430 -1.534600 2.079004
H 0.133185 -0.988698 -0.641064
H -0.354168 2.653551 0.027017
H -1.229694 -2.118072 -0.485924
H -4.499811 2.126753 1.070878
H -2.508992 3.591645 0.753260
H -5.530140 -0.090153 1.007039
H -3.231724 -3.534198 -0.169201
H -5.371780 -2.539247 0.575094


%chk=000235438-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235438

0 1
O 1.248735 2.280513 -0.685501
N 2.399093 0.253261 -0.543137
N 4.953997 -0.782747 0.292681
N 0.037018 0.285340 -0.339145
C 2.548131 -1.174610 -0.202281
C 3.654980 0.901862 -0.978377
C 3.700972 -1.374101 0.808700
C 4.776310 0.670355 0.048055
C 1.223356 1.019368 -0.526372
C 6.113732 -1.077151 1.156860
C -1.277552 0.785351 -0.143838
C -2.340532 -0.186327 0.061763
C -3.692582 0.299838 0.265168
C -1.572215 2.159638 -0.140497
C -2.130112 -1.607146 0.076580
C -3.953948 1.708486 0.267189
C -2.907972 2.609290 0.069365
C -4.754374 -0.644378 0.464406
C -3.184733 -2.503278 0.273001
C -4.514333 -2.018719 0.468568
H 2.769300 -1.763372 -1.116539
H 1.629237 -1.573294 0.261203
H 3.447806 1.976484 -1.101474
H 3.966224 0.475430 -1.953804
H 3.401236 -0.921319 1.789792
H 3.855130 -2.458222 0.966267
H 5.722159 1.081305 -0.350630
H 4.530307 1.220743 0.991805
H 6.020398 -0.649539 2.186855
H 7.029914 -0.665083 0.697811
H 6.241356 -2.170677 1.250032
H 0.112952 -0.727946 -0.389375
H -0.762851 2.871012 -0.309895
H -1.129749 -2.036688 -0.063691
H -4.979978 2.060054 0.423388
H -3.102619 3.687415 0.067470
H -5.770018 -0.259137 0.614906
H -2.991857 -3.581628 0.278368
H -5.336125 -2.726478 0.621421


