%chk=000196441.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196441

0 1
O -1.149618 -2.815055 1.009796
O -4.909381 0.550347 -0.757387
N 1.442303 1.606755 0.098964
N -3.260739 -2.329844 0.453401
N -4.244572 -1.448042 -0.009349
N 6.053536 -2.620094 -0.378527
C 2.503764 0.730715 0.661678
C 3.146679 -0.123296 -0.444949
C 0.122337 1.190948 0.008094
C 4.318357 -0.937503 0.110581
C 1.849222 2.999649 -0.224418
C -0.243639 -0.142777 0.352189
C -1.561471 -0.553115 0.227731
C -0.895808 2.075266 -0.456739
C 4.911522 -1.860716 -0.967604
C -2.562141 0.322189 -0.235892
C 1.672032 3.938224 0.967683
C -2.204826 1.641605 -0.575430
C -1.914907 -1.957760 0.596486
C -3.958133 -0.109861 -0.369730
H 2.079480 0.075150 1.458466
H 3.270990 1.361467 1.163630
H 3.486445 0.522956 -1.276995
H 2.385139 -0.797470 -0.888140
H 5.101810 -0.265520 0.509749
H 3.991446 -1.557233 0.972261
H 2.912524 2.990270 -0.556539
H 1.256726 3.365424 -1.096163
H 0.500376 -0.856358 0.714994
H -0.648474 3.100796 -0.723228
H 4.142321 -2.597215 -1.294142
H 5.192112 -1.271550 -1.866936
H 0.631698 3.957083 1.319871
H 2.289056 3.637841 1.822915
H 1.949087 4.966075 0.706179
H -2.985735 2.321202 -0.934651
H -3.569351 -3.276567 0.689846
H -5.195398 -1.818671 -0.076124
H 6.828506 -2.000034 -0.167297
H 6.395230 -3.313281 -1.036672


%chk=000196441-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000196441

0 1
O -1.018107 -2.878388 0.883942
O -4.993582 0.609564 -0.678983
N 1.439268 1.647945 0.156895
N -3.210666 -2.359469 0.382525
N -4.232067 -1.466968 -0.016128
N 6.056353 -2.678575 -0.396588
C 2.511346 0.760550 0.656991
C 3.151033 -0.127958 -0.438515
C 0.122380 1.208724 0.043822
C 4.304835 -0.992130 0.115427
C 1.838740 3.018245 -0.227672
C -0.238850 -0.145236 0.327255
C -1.570848 -0.579105 0.212569
C -0.932962 2.100512 -0.365604
C 4.944547 -1.891066 -0.963345
C -2.606248 0.314068 -0.198470
C 1.651218 4.056531 0.903377
C -2.254248 1.657334 -0.484134
C -1.871042 -2.006937 0.519479
C -4.011355 -0.120217 -0.326948
H 2.121909 0.128138 1.476617
H 3.295239 1.399831 1.107372
H 3.524173 0.521568 -1.256795
H 2.374185 -0.780007 -0.883073
H 5.087197 -0.332846 0.550121
H 3.946465 -1.642358 0.936550
H 2.903938 2.984103 -0.522698
H 1.281734 3.328197 -1.131305
H 0.496665 -0.894675 0.630816
H -0.713737 3.149747 -0.579791
H 4.179970 -2.599791 -1.335334
H 5.238121 -1.251431 -1.833612
H 0.594307 4.122330 1.214791
H 2.247773 3.780398 1.791406
H 1.977607 5.058215 0.567552
H -3.050507 2.342296 -0.793812
H -3.482765 -3.324468 0.581181
H -5.181973 -1.837257 -0.081335
H 6.842606 -2.113048 -0.061729
H 6.365856 -3.464366 -0.975216


