%chk=000275353.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275353

0 1
O -2.428026 1.526064 1.474875
O -1.008447 -1.189614 -1.692829
N 0.427484 0.277601 0.111866
N 1.317212 -0.538024 0.426102
N -1.176413 -1.389159 2.726550
C -0.974172 -0.096667 0.460285
C -1.617590 2.157931 -0.721947
C -3.046698 -1.427552 -0.400103
C -1.755269 1.272351 0.513510
C -1.619163 -0.962681 -0.686678
C -3.015720 2.454254 -1.264664
C -0.873669 3.429427 -0.310738
C -3.929949 -1.050404 -1.588978
C -3.013380 -2.937154 -0.160236
C -1.093410 -0.816494 1.728265
C 2.685060 -0.227165 0.087472
C 3.652354 -0.833837 0.911790
C 3.068870 0.558396 -1.014018
C 5.005080 -0.637383 0.630449
C 4.426947 0.736229 -1.285087
C 5.392873 0.143733 -0.464504
H -1.020296 1.635131 -1.514770
H -3.448031 -0.926091 0.519570
H -2.966449 3.128226 -2.128459
H -3.648860 2.940911 -0.509269
H -3.532257 1.535965 -1.591914
H 0.139954 3.200910 0.045544
H -1.396645 3.967686 0.491146
H -0.775470 4.118733 -1.157618
H -3.972209 0.042812 -1.734738
H -4.958332 -1.402914 -1.443047
H -3.562476 -1.495930 -2.524316
H -2.598844 -3.479733 -1.020678
H -4.024011 -3.328555 0.013142
H -2.412578 -3.199990 0.720696
H 3.340769 -1.448234 1.758813
H 2.310815 1.014850 -1.652144
H 5.761610 -1.098424 1.265246
H 4.733682 1.339186 -2.139289
H 6.451255 0.288411 -0.679696


%chk=000275353-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275353

0 1
O -2.848763 1.612405 1.134851
O -1.731394 -0.506548 -2.054768
N 0.217401 0.194124 -0.204868
N 1.106779 -0.292394 0.602564
N -1.371937 -1.149449 2.678375
C -1.189711 0.014024 0.287872
C -1.496501 2.449412 -0.741091
C -3.069411 -1.754628 -0.419504
C -1.933200 1.427997 0.303950
C -1.994428 -0.765234 -0.860904
C -2.711407 3.250573 -1.260927
C -0.438437 3.384544 -0.078747
C -4.231904 -1.794046 -1.435931
C -2.402051 -3.157587 -0.265294
C -1.301761 -0.632137 1.606616
C 2.468465 -0.156880 0.160493
C 3.441253 -0.587804 1.098292
C 2.862971 0.349433 -1.110023
C 4.812059 -0.503026 0.775587
C 4.232397 0.425259 -1.423696
C 5.208926 0.003211 -0.484241
H -1.009314 1.905952 -1.569527
H -3.445961 -1.443022 0.573214
H -2.371617 4.022561 -1.974190
H -3.240201 3.746916 -0.429084
H -3.431076 2.595222 -1.783535
H 0.442587 2.822546 0.277147
H -0.881205 3.928824 0.774256
H -0.093660 4.123273 -0.823866
H -4.739341 -0.815465 -1.507319
H -4.976570 -2.545746 -1.119812
H -3.863777 -2.061704 -2.441067
H -2.014940 -3.506631 -1.239084
H -3.159824 -3.878294 0.088799
H -1.575855 -3.149377 0.465996
H 3.097419 -0.977715 2.061787
H 2.093288 0.661817 -1.822860
H 5.565532 -0.831545 1.498867
H 4.547951 0.808474 -2.400268
H 6.272818 0.065466 -0.738457


