%chk=000217614.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217614

0 1
O -0.029280 1.334515 -1.637830
N -2.550444 -0.157491 0.253917
N 0.272663 0.340856 0.422842
C -1.994269 1.142964 -0.252940
C -2.595187 -1.172252 -0.857835
C -3.868992 -0.024547 0.941557
C -0.490073 0.935051 -0.581123
C -2.095075 2.283006 0.761642
C 1.665212 -0.007073 0.283849
C -2.727754 -2.581753 -0.281100
C -5.019885 0.528819 0.098284
C 2.047528 -1.360740 0.450168
C 2.637064 0.988824 0.034156
C 3.403646 -1.700905 0.376237
C 3.987194 0.610186 -0.045990
C 1.029070 -2.424670 0.706691
C 2.261223 2.419411 -0.151010
C 4.366454 -0.720140 0.125777
H -2.485506 1.465851 -1.211792
H -3.418302 -0.975960 -1.579449
H -1.648316 -1.106103 -1.441180
H -4.138960 -1.035805 1.324516
H -3.719142 0.607276 1.844639
H -1.505486 3.149412 0.430960
H -3.128556 2.627304 0.886127
H -1.720728 1.989292 1.750563
H -0.218731 -0.105657 1.204264
H -2.014351 -2.747473 0.536696
H -3.729816 -2.768192 0.121985
H -2.535527 -3.336520 -1.051942
H -4.813190 1.540154 -0.268544
H -5.221573 -0.099617 -0.777152
H -5.945571 0.577068 0.682542
H 3.709943 -2.736455 0.506579
H 4.744198 1.366307 -0.245763
H 0.619242 -2.350244 1.723661
H 0.185549 -2.356238 0.001800
H 1.446763 -3.434875 0.602540
H 3.126256 3.090898 -0.177248
H 1.716072 2.544057 -1.109713
H 1.588316 2.772111 0.641673
H 5.417620 -0.997452 0.062842


%chk=000217614-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217614

0 1
O 0.085738 1.592567 -1.816249
N -2.447937 -0.090322 0.201908
N 0.231101 0.211558 0.098528
C -1.953308 1.137783 -0.502006
C -2.616443 -1.207178 -0.779438
C -3.611809 0.087085 1.117473
C -0.436914 0.989990 -0.832443
C -2.105244 2.447873 0.306361
C 1.635623 -0.064014 0.173017
C -2.878795 -2.575551 -0.127160
C -4.977174 0.390594 0.446210
C 2.045081 -1.427607 0.292071
C 2.592500 0.995503 0.185166
C 3.424294 -1.720953 0.391130
C 3.965992 0.653650 0.270431
C 1.022290 -2.549710 0.301706
C 2.182105 2.452906 0.152165
C 4.386732 -0.688256 0.368438
H -2.457658 1.276920 -1.485169
H -3.427928 -0.980562 -1.511006
H -1.680795 -1.261447 -1.367585
H -3.701901 -0.833346 1.723045
H -3.362634 0.892513 1.828602
H -1.607311 3.259473 -0.251491
H -3.162841 2.731184 0.443762
H -1.625442 2.367074 1.298582
H -0.440414 -0.294254 0.706033
H -2.106618 -2.806423 0.628213
H -3.867153 -2.624892 0.363186
H -2.852998 -3.366579 -0.898456
H -4.928358 1.293745 -0.188782
H -5.321640 -0.449023 -0.183860
H -5.746700 0.563149 1.221367
H 3.742643 -2.766801 0.474522
H 4.708318 1.460456 0.275545
H 0.388516 -2.527653 1.211116
H 0.342950 -2.485303 -0.568488
H 1.520426 -3.533362 0.274807
H 3.028048 3.103694 0.431870
H 1.824928 2.736429 -0.854575
H 1.346385 2.649895 0.850366
H 5.453643 -0.927608 0.436986


