%chk=000208653.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208653

0 1
O -1.190859 -0.507588 -0.243567
O -3.751493 2.289632 1.138879
O 1.080026 0.342936 0.141488
O -0.872282 -2.468396 0.858408
O 4.425756 -2.041272 0.498294
N -1.539821 2.089236 0.688030
C -3.144653 0.744454 -0.640878
C -2.671500 -0.667975 -0.261997
C -4.654016 0.716407 -0.949177
C -3.008313 -1.723312 -1.313238
C -4.993139 -0.324166 -2.019713
C -4.511784 -1.721926 -1.610520
C -2.877241 1.750895 0.482303
C -0.435296 -1.457084 0.372153
C 1.008180 -1.028943 0.327476
C 2.064455 -1.842905 0.452866
C 2.359223 0.905506 0.075261
C 3.527234 0.141457 0.193844
C 3.455432 -1.325097 0.393517
C 2.366570 2.295834 -0.118867
C 4.762988 0.814901 0.115723
C 3.604579 2.928197 -0.191516
C 4.798576 2.192459 -0.073803
H -2.590263 1.074732 -1.558365
H -2.984042 -0.969171 0.760117
H -4.980668 1.725891 -1.270571
H -5.221062 0.516631 -0.015484
H -2.685031 -2.723635 -0.957339
H -2.432610 -1.530930 -2.240744
H -4.539283 -0.036367 -2.987938
H -6.087164 -0.337556 -2.191363
H -5.073826 -2.070843 -0.721444
H -4.733465 -2.451305 -2.413238
H -1.300643 2.681716 1.469692
H -0.783903 1.531512 0.303359
H 1.957519 -2.921668 0.611443
H 1.432703 2.846048 -0.213992
H 5.684306 0.229521 0.207387
H 3.650640 4.009143 -0.342394
H 5.755768 2.710230 -0.133090


%chk=000208653-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208653

0 1
O -1.199356 -0.383495 -0.361662
O -4.017051 2.166561 1.349779
O 1.231545 0.458602 -0.060014
O -0.774414 -2.444622 0.663551
O 4.425698 -2.045884 0.995919
N -1.769399 2.090904 0.787682
C -3.360909 0.741694 -0.564967
C -2.689964 -0.642989 -0.396365
C -4.888921 0.557357 -0.758095
C -2.999743 -1.596664 -1.564175
C -5.214827 -0.397514 -1.926891
C -4.528014 -1.768667 -1.733688
C -3.088735 1.713724 0.614507
C -0.388747 -1.337134 0.223100
C 1.040843 -0.885031 0.272948
C 2.064467 -1.727120 0.629965
C 2.551433 0.968896 -0.044436
C 3.660548 0.154501 0.306457
C 3.464513 -1.276338 0.673369
C 2.696133 2.327416 -0.395343
C 4.952656 0.743650 0.297593
C 3.987786 2.885917 -0.394945
C 5.118367 2.094872 -0.048269
H -2.932042 1.195385 -1.483340
H -2.964512 -1.110400 0.569327
H -5.344698 1.550169 -0.916886
H -5.325806 0.174052 0.183292
H -2.513601 -2.571036 -1.380862
H -2.568609 -1.168805 -2.490867
H -4.875164 0.049775 -2.883989
H -6.310731 -0.527500 -2.005233
H -4.947598 -2.270236 -0.838113
H -4.727889 -2.433028 -2.594931
H -1.552526 2.729221 1.553580
H -1.017438 1.631334 0.269213
H 1.828032 -2.762721 0.886796
H 1.813432 2.914840 -0.664355
H 5.800132 0.105794 0.569580
H 4.119803 3.938613 -0.665722
H 6.116906 2.543107 -0.052508


