%chk=000276711.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276711

0 1
O -2.918645 0.000526 -2.606033
N -0.792187 0.000278 -1.675563
C -0.149632 0.000077 -0.328630
C 0.781478 -1.193115 -0.105706
C 0.781866 1.192943 -0.105576
C -1.360674 0.000219 0.599672
C 2.088613 -0.736401 0.239334
C 2.088851 0.735765 0.239416
C -2.549990 0.000415 -0.171709
C -2.202294 0.000374 -1.628494
C 0.499541 -2.542876 -0.194596
C 0.500370 2.542805 -0.194331
C 0.004440 0.000100 -2.910530
C -1.410484 0.000205 1.982109
C 3.103808 -1.643440 0.500526
C 3.104342 1.642446 0.500705
C -3.796099 0.000609 0.430737
C 1.535997 -3.460647 0.069714
C 1.537123 3.460209 0.070082
C -2.678197 0.000391 2.596674
C 2.812380 -3.018333 0.412066
C 2.813361 3.017443 0.412393
C -3.848909 0.000590 1.837731
H -0.496086 -2.893183 -0.463127
H -0.495141 2.893460 -0.462838
H -0.672660 0.000183 -3.786528
H 0.645552 -0.896721 -2.963639
H 0.645837 0.896719 -2.963687
H -0.501057 0.000059 2.579949
H 4.103049 -1.308065 0.766446
H 4.103474 1.306717 0.766584
H -4.707047 0.000763 -0.168693
H 1.329786 -4.528166 0.003700
H 1.331260 4.527802 0.004183
H -2.739218 0.000381 3.685356
H 3.600981 -3.742412 0.614381
H 3.602195 3.741244 0.614791
H -4.818286 0.000736 2.334730


%chk=000276711-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000276711

0 1
O -2.959816 0.000630 -2.634141
N -0.790304 0.000264 -1.670108
C -0.144761 0.000102 -0.328993
C 0.803928 -1.194909 -0.101060
C 0.804328 1.194773 -0.100960
C -1.370248 0.000252 0.596454
C 2.107106 -0.739908 0.247987
C 2.107354 0.739304 0.248050
C -2.550926 0.000492 -0.176693
C -2.192928 0.000610 -1.628014
C 0.514594 -2.564004 -0.199102
C 0.515460 2.563974 -0.198893
C -0.029676 0.000069 -2.916198
C -1.429759 0.000149 2.000678
C 3.136500 -1.667960 0.512636
C 3.137063 1.666985 0.512771
C -3.825454 0.000611 0.420560
C 1.550847 -3.497197 0.059754
C 1.552031 3.496795 0.060035
C -2.707825 0.000282 2.612842
C 2.848187 -3.050661 0.415184
C 2.849220 3.049791 0.415428
C -3.894583 0.000508 1.832959
H -0.490532 -2.906806 -0.469083
H -0.489549 2.907140 -0.468846
H -0.757135 0.000275 -3.744968
H 0.610168 -0.898745 -2.992662
H 0.610652 0.898538 -2.992639
H -0.518436 -0.000039 2.608292
H 4.143394 -1.333076 0.785662
H 4.143843 1.331736 0.785768
H -4.724831 0.000798 -0.203864
H 1.347608 -4.571218 -0.013315
H 1.349156 4.570890 -0.012950
H -2.782084 0.000203 3.706133
H 3.636572 -3.785046 0.614778
H 3.637854 3.783893 0.615078
H -4.869322 0.000607 2.333040


