%chk=000218411.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218411

0 1
O -2.805464 -1.646478 -0.377949
N 1.151659 0.566935 0.331005
N 3.975995 0.169299 -0.112388
N -2.576893 0.270835 0.836923
N 5.863955 -1.249966 0.181551
N -6.641152 -0.310907 -1.639991
N -8.719504 0.574189 -0.986987
C 1.984485 1.626581 -0.326918
C 1.690152 -0.785795 -0.032490
C 3.431006 1.525048 0.198999
C 3.138011 -0.922087 0.474751
C -0.289006 0.696251 -0.058293
C -1.131284 0.049637 1.065431
C 5.375694 0.006582 -0.119851
C 6.242186 1.057711 -0.531296
C 7.601203 0.793690 -0.655841
C -3.324179 -0.639743 0.079252
C 7.193181 -1.470346 0.041530
C 8.099814 -0.483136 -0.370192
C -4.755852 -0.292482 -0.112226
C -5.563770 0.232559 0.908232
C -5.346900 -0.568765 -1.366213
C -6.903411 0.505655 0.664030
C -7.417682 0.240169 -0.633843
H 1.571164 2.621475 -0.055078
H 1.981266 1.555157 -1.436786
H 1.652730 -0.985636 -1.126326
H 1.059589 -1.559496 0.458826
H 4.056140 2.305398 -0.289228
H 3.447977 1.717484 1.296379
H 3.166600 -0.893943 1.586316
H 3.549156 -1.911117 0.161780
H -0.555041 1.769653 -0.155899
H -0.532568 0.221689 -1.034103
H -0.931983 -1.048563 1.108518
H -0.848644 0.472074 2.054678
H -2.946005 1.179919 1.085846
H 5.844151 2.040668 -0.763035
H 8.280952 1.583674 -0.976938
H 7.528732 -2.486516 0.283577
H 9.156594 -0.704186 -0.462733
H -5.145195 0.416063 1.900290
H -4.755810 -1.022524 -2.177635
H -7.540250 0.914727 1.440518
H -9.405919 0.717156 -0.266635
H -9.074983 0.253111 -1.878359


%chk=000218411-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218411

0 1
O -2.680052 -1.622677 -0.387405
N 1.194675 0.674481 0.563799
N 4.041312 0.266408 0.324162
N -2.585033 0.321152 0.884744
N 5.686250 -1.324609 -0.226750
N -6.645710 -0.811022 -1.598561
N -8.732074 0.161451 -1.219945
C 2.065430 1.721056 -0.021881
C 1.745473 -0.672610 0.249940
C 3.498229 1.615407 0.543793
C 3.166234 -0.817448 0.819088
C -0.229407 0.827295 0.185155
C -1.163605 0.143699 1.215779
C 5.340742 0.004265 -0.109918
C 6.283177 1.038571 -0.431104
C 7.559973 0.675824 -0.892960
C -3.266841 -0.598652 0.093360
C 6.929898 -1.643262 -0.673288
C 7.909172 -0.691383 -1.028420
C -4.715328 -0.317583 -0.162831
C -5.531562 0.539209 0.628605
C -5.342754 -0.971393 -1.255896
C -6.884295 0.721983 0.306019
C -7.413618 0.032079 -0.829421
H 1.653368 2.714889 0.235551
H 2.115338 1.644570 -1.138322
H 1.768147 -0.848434 -0.854483
H 1.099856 -1.446904 0.699552
H 4.126642 2.372534 0.049792
H 3.469116 1.842849 1.631525
H 3.114691 -0.773318 1.928066
H 3.620391 -1.774588 0.521857
H -0.462880 1.909690 0.157101
H -0.451060 0.412872 -0.827472
H -0.972679 -0.942110 1.236731
H -0.959480 0.556786 2.219834
H -3.039388 1.196705 1.144727
H 6.036445 2.096698 -0.314871
H 8.285049 1.459617 -1.140178
H 7.140304 -2.717651 -0.744116
H 8.895007 -1.003949 -1.383118
H -5.131599 1.037623 1.519937
H -4.752849 -1.657665 -1.872451
H -7.526375 1.365935 0.915958
H -9.387126 0.754438 -0.719420
H -9.040304 -0.371126 -2.031063


