%chk=000255082.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255082

0 1
O -0.253526 1.457398 -1.193520
O -3.838404 -2.208378 -0.766298
N 1.712505 -0.018081 0.376558
N 1.536427 1.106054 1.178368
N 2.586547 1.835167 1.176696
C -0.612555 -0.672204 -0.179549
C 0.696764 -1.017167 0.193804
C -1.588923 -1.687147 -0.211998
C -2.425817 1.082218 -0.311528
C -1.002924 0.717254 -0.602675
C -3.411627 0.078746 -0.274109
C -3.034381 -1.353110 -0.465961
C 3.007719 0.032131 -0.190164
C 1.048797 -2.361822 0.440998
C -1.244344 -3.018937 0.024897
C 0.080609 -3.355317 0.336693
C 3.572944 1.244628 0.336999
C -2.776595 2.419349 -0.117718
C -4.748294 0.422616 -0.054374
C 3.729698 -0.793463 -1.069833
C -4.116494 2.757415 0.121965
C -5.097371 1.764923 0.149597
C 4.877647 1.636816 -0.010879
C 5.011348 -0.382597 -1.395249
C 5.579227 0.812154 -0.873071
H 2.072771 -2.613934 0.724994
H -2.016151 -3.793768 -0.034200
H 0.347995 -4.399028 0.513579
H -2.005395 3.194055 -0.157981
H -5.512933 -0.359051 -0.045761
H 3.289993 -1.698340 -1.478950
H -4.388860 3.801602 0.281402
H -6.139982 2.030585 0.327389
H 5.297129 2.558103 0.391796
H 5.613906 -0.985536 -2.076810
H 6.593550 1.076667 -1.171808


%chk=000255082-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255082

0 1
O -0.057362 1.566203 -0.580443
O -3.945189 -2.259958 -0.102749
N 1.808179 -0.193010 0.520880
N 1.696141 0.762997 1.604790
N 2.791069 1.512344 1.586909
C -0.578293 -0.716980 0.071283
C 0.767096 -1.137215 0.293646
C -1.597347 -1.718330 0.031365
C -2.381682 1.081373 -0.215563
C -0.931045 0.712872 -0.237586
C -3.401428 0.090056 -0.138821
C -3.050619 -1.356358 -0.081882
C 3.004001 0.002460 -0.154146
C 1.089640 -2.511945 0.370775
C -1.264724 -3.091540 0.114245
C 0.078266 -3.489441 0.255877
C 3.626355 1.097603 0.527206
C -2.739125 2.449506 -0.298826
C -4.764726 0.476922 -0.146582
C 3.605617 -0.617462 -1.273936
C -4.096687 2.828253 -0.293238
C -5.112017 1.840221 -0.217157
C 4.881558 1.597756 0.108172
C 4.853567 -0.108721 -1.680786
C 5.485858 0.980224 -1.001582
H 2.128704 -2.802368 0.557495
H -2.080168 -3.819895 0.070110
H 0.337645 -4.551082 0.315675
H -1.937897 3.191807 -0.366156
H -5.526406 -0.307672 -0.099246
H 3.125400 -1.442410 -1.808574
H -4.368707 3.887634 -0.348389
H -6.165761 2.138342 -0.216214
H 5.349352 2.435736 0.632686
H 5.355340 -0.556270 -2.545782
H 6.456394 1.338350 -1.360158


