%chk=000294090.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294090

0 1
O -3.752372 1.316857 -0.021066
O 3.752199 -1.316624 -0.022208
N -7.604261 -0.426929 0.194304
N 7.604218 0.426724 0.194820
N -2.732953 -0.749670 0.002966
N 2.732904 0.749918 0.004151
C -8.858222 0.375404 0.061765
C -8.313607 -0.394231 -1.122151
C 8.858117 -0.375548 0.061328
C 8.313423 0.395329 -1.121743
C -6.329938 0.329496 0.306344
C 6.329861 -0.329740 0.306222
C -5.178134 -0.633158 -0.026628
C 5.178080 0.633317 -0.025667
C -3.854536 0.104795 -0.009072
C 3.854451 -0.104587 -0.008806
C -1.359619 -0.337931 0.003715
C 1.359572 0.338217 0.004258
C -0.376641 -1.349271 0.003630
C 0.974267 -1.014312 0.003894
C -0.974314 1.014598 0.004540
C 0.376599 1.349557 0.004813
H -8.838622 1.465741 0.065762
H -9.712950 -0.010129 0.625866
H -8.773057 -1.339784 -1.423479
H -7.897429 0.137813 -1.977978
H 8.838452 -1.465888 0.064215
H 9.712926 0.009357 0.625735
H 8.772897 1.341163 -1.422151
H 7.897123 -0.135814 -1.978070
H -6.241046 0.681398 1.360505
H -6.260758 1.238757 -0.332541
H 6.260567 -1.238351 -0.333574
H 6.241054 -0.682693 1.360038
H -5.195707 -1.482527 0.689307
H -5.341940 -1.089098 -1.026914
H 5.195741 1.481935 0.691155
H 5.341842 1.090298 -1.025487
H -2.883793 -1.759890 0.017690
H 2.883786 1.760115 0.019980
H -0.659720 -2.400653 0.003864
H 1.732859 -1.806697 0.004121
H -1.732895 1.806996 0.005283
H 0.659676 2.400939 0.005963


%chk=000294090-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294090

0 1
O -3.834983 1.446195 -0.389424
O 3.835100 -1.445819 -0.390702
N -7.561704 -0.658880 0.359547
N 7.561546 0.658835 0.360297
N -2.772573 -0.648810 -0.375771
N 2.772482 0.649095 -0.375410
C -8.774882 0.120153 0.803295
C -8.478079 -0.051141 -0.679328
C 8.774717 -0.120553 0.803445
C 8.478071 0.052127 -0.679049
C -6.256261 0.037076 0.534400
C 6.256134 -0.037377 0.534370
C -5.231221 -0.568319 -0.447081
C 5.231135 0.568871 -0.446628
C -3.895404 0.178239 -0.396321
C 3.895378 -0.177851 -0.396725
C -1.394435 -0.285183 -0.373965
C 1.394347 0.285423 -0.373817
C -0.434494 -1.331258 -0.373727
C 0.945966 -1.062660 -0.373082
C -0.946058 1.062894 -0.372158
C 0.434402 1.331493 -0.372663
H -8.620692 1.121042 1.230283
H -9.564170 -0.469909 1.278793
H -9.051586 -0.766415 -1.276799
H -8.123532 0.836051 -1.223445
H 8.620524 -1.121856 1.229463
H 9.563920 0.469098 1.279592
H 9.051615 0.767991 -1.275776
H 8.123628 -0.834568 -1.224044
H -5.925886 -0.126524 1.577065
H -6.311393 1.136434 0.361489
H 6.311364 -1.136566 0.360419
H 5.925657 0.125209 1.577161
H -5.118783 -1.648617 -0.238466
H -5.634477 -0.476370 -1.475250
H 5.118568 1.648959 -0.237005
H 5.634495 0.477932 -1.474845
H -2.959088 -1.654362 -0.370705
H 2.958944 1.654653 -0.369490
H -0.768517 -2.377212 -0.374255
H 1.678474 -1.871241 -0.372126
H -1.678571 1.871473 -0.370508
H 0.768421 2.377448 -0.372358


