%chk=000256657.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256657

0 1
O 2.876582 1.506169 0.969512
O 5.101816 -0.068705 0.105079
N -0.948510 -2.192598 0.093918
N -0.882024 -0.932180 -2.031374
C -0.158001 -1.871690 -1.128483
C -2.182175 -0.085420 -0.132512
C -1.774213 -1.203098 0.673215
C -1.706777 0.073434 -1.479218
C 1.229367 -1.342375 -0.771218
C -3.089473 0.865507 0.403015
C -2.240717 -1.341422 1.975418
C -2.108417 1.161758 -2.245215
C -3.562205 0.692552 1.740071
C -3.494773 1.967921 -0.410308
C 1.363290 -0.140867 -0.054387
C 2.361561 -2.057805 -1.160274
C -3.148389 -0.384638 2.489901
C -3.017184 2.097059 -1.694471
C 2.629024 0.338949 0.269664
C 3.639641 -1.586770 -0.841079
C 3.788780 -0.391064 -0.127180
C 1.728265 2.283039 1.395161
C 5.391327 1.150513 0.836644
H -0.069632 -2.845052 -1.702947
H -0.440994 -2.793406 0.747604
H -0.328853 -0.661677 -2.847847
H -1.942247 -2.177503 2.597623
H -1.758547 1.297872 -3.262228
H 0.467601 0.406602 0.242402
H -4.258877 1.420325 2.145696
H -4.191627 2.692054 0.001467
H 2.267256 -2.990191 -1.716206
H -3.515341 -0.518712 3.508757
H -3.332668 2.936229 -2.316534
H 4.531892 -2.137013 -1.139663
H 2.209729 3.124271 1.909179
H 1.108960 1.702481 2.085734
H 1.156960 2.627093 0.527557
H 6.486821 1.139511 0.864005
H 4.958955 1.096931 1.841423
H 5.007015 2.017319 0.288599


%chk=000256657-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256657

0 1
O 2.878436 1.453649 1.270527
O 5.155413 -0.080233 0.481131
N -1.002533 -2.174381 0.064565
N -0.843298 -0.929254 -1.973363
C -0.125570 -1.862346 -1.081696
C -2.233600 -0.079941 -0.157319
C -1.863566 -1.225908 0.632097
C -1.698208 0.068125 -1.485828
C 1.264308 -1.351317 -0.661918
C -3.157984 0.894693 0.366361
C -2.403508 -1.386356 1.923678
C -2.076496 1.175777 -2.270206
C -3.688725 0.702486 1.685652
C -3.521517 2.011851 -0.457682
C 1.402236 -0.155479 0.090340
C 2.420246 -2.079667 -1.018952
C -3.315568 -0.418927 2.435648
C -2.989278 2.136050 -1.746312
C 2.675151 0.309097 0.482447
C 3.699404 -1.608283 -0.647136
C 3.849295 -0.417931 0.093452
C 1.686790 2.175820 1.734329
C 5.611686 1.311007 0.277008
H 0.032504 -2.804365 -1.645063
H -0.678798 -2.933902 0.664287
H -0.400839 -0.767657 -2.878534
H -2.127196 -2.256005 2.531868
H -1.674351 1.295988 -3.283304
H 0.504492 0.398106 0.378999
H -4.391847 1.438139 2.091350
H -4.223332 2.757585 -0.068381
H 2.328598 -3.009251 -1.594568
H -3.726020 -0.563329 3.441772
H -3.272853 2.989309 -2.373364
H 4.610721 -2.150816 -0.917064
H 2.075011 2.999694 2.350791
H 1.037526 1.521707 2.346498
H 1.106372 2.583318 0.884648
H 6.670178 1.304170 0.578737
H 5.032068 2.013561 0.896218
H 5.527849 1.590619 -0.791213


