%chk=000194460.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194460

0 1
O 5.347225 1.865102 -0.341956
O -1.465713 -0.011452 -2.325981
N 2.149547 0.098771 -0.028446
C 3.618927 0.169558 -0.206721
C 1.173570 0.176961 -1.032510
C 1.496643 -0.099870 1.225272
C -0.084237 0.041633 -0.418581
C 0.133557 -0.132946 0.990358
C 4.014072 1.562377 -0.762428
C 4.119049 -0.969935 -1.095679
C 1.464829 0.391973 -2.462674
C 2.227523 -0.231598 2.502632
C -1.368989 0.039203 -1.109665
C -2.609192 0.091450 -0.261466
C -2.783057 1.108117 0.686259
C -3.610113 -0.869196 -0.456222
C -3.955794 1.156778 1.445196
C -4.777147 -0.822525 0.312021
C -4.950140 0.189810 1.261567
H 4.103232 0.072086 0.807463
H -0.641412 -0.276023 1.718458
H 3.416588 2.373778 -0.299191
H 3.935560 1.628413 -1.859211
H 3.831387 -1.948855 -0.686898
H 3.699228 -0.920069 -2.112890
H 5.210696 -0.960517 -1.180822
H 1.659456 1.449807 -2.689295
H 2.312406 -0.207916 -2.826759
H 0.575260 0.109226 -3.072344
H 1.526125 -0.339763 3.345313
H 2.878708 -1.118014 2.518095
H 2.847792 0.651276 2.719962
H 5.995587 1.325656 -0.838485
H -2.006145 1.859986 0.826772
H -3.476899 -1.644250 -1.211970
H -4.095252 1.948565 2.178515
H -5.553458 -1.571096 0.165377
H -5.861421 0.227601 1.856036


%chk=000194460-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194460

0 1
O 5.428446 1.929589 -0.653874
O -1.498130 -0.456827 -2.266328
N 2.164585 0.130218 -0.022415
C 3.631861 0.277654 -0.211379
C 1.167789 0.139056 -1.006223
C 1.579539 -0.115911 1.249833
C -0.074101 -0.079138 -0.351997
C 0.207641 -0.236716 1.060959
C 4.010487 1.621944 -0.890842
C 4.261494 -0.955435 -0.900395
C 1.407467 0.405450 -2.467712
C 2.378788 -0.226283 2.518299
C -1.385385 -0.197403 -1.017029
C -2.648787 -0.025512 -0.205930
C -2.742124 0.865193 0.896548
C -3.810356 -0.727098 -0.625909
C -3.970796 1.038808 1.571834
C -5.031730 -0.567482 0.059087
C -5.115483 0.316469 1.162476
H 4.062486 0.347492 0.802876
H -0.515186 -0.468741 1.840141
H 3.455670 2.446978 -0.415001
H 3.786045 1.614104 -1.974287
H 3.979516 -1.880445 -0.368922
H 3.941059 -1.056044 -1.951657
H 5.364779 -0.881191 -0.877822
H 1.604857 1.476118 -2.670368
H 2.253097 -0.176541 -2.875420
H 0.496686 0.117014 -3.014545
H 1.691608 -0.445703 3.352143
H 3.127662 -1.041582 2.487248
H 2.914726 0.709250 2.772248
H 5.989955 1.392474 -1.266804
H -1.864104 1.443189 1.202249
H -3.730625 -1.383503 -1.498777
H -4.036738 1.740627 2.410936
H -5.918364 -1.123370 -0.265784
H -6.066333 0.447401 1.691645


