%chk=000211402.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211402

0 1
O 3.097966 0.381582 0.931028
O -2.664379 1.773739 -0.666388
O 1.918387 -1.228262 -1.082177
O -1.964080 -0.385709 -1.256860
N -0.023606 2.161789 0.703982
C 2.245255 1.347565 0.166990
C 0.728849 0.959364 0.254716
C 2.331302 2.718957 0.890682
C 0.947580 2.855318 1.604164
C -0.541929 3.048953 -0.363925
C -1.491603 2.366367 -1.358331
C 3.823854 -0.606676 0.242125
C 3.264209 -1.459769 -0.762117
C 5.160235 -0.810908 0.648161
C 4.058614 -2.474819 -1.344926
C -2.761678 0.379503 -0.641958
C 5.947356 -1.835838 0.074924
C 5.397157 -2.662658 -0.927868
C -3.926719 -0.080982 0.168228
C 1.232929 -2.168076 -1.973886
C -4.205899 -1.471925 0.205915
C -4.742049 0.825171 0.894573
C -5.294698 -1.952886 0.961317
C -5.830485 0.339034 1.649089
C -6.109489 -1.048131 1.683482
H 2.623057 1.384412 -0.869683
H 0.332789 0.545016 -0.678700
H 0.643400 0.169770 1.023154
H 2.464791 3.532282 0.153512
H 3.188171 2.736272 1.583625
H 0.641574 3.898703 1.792020
H 0.969886 2.319560 2.571722
H 0.258892 3.518761 -0.997705
H -1.080516 3.877847 0.133008
H -0.994691 1.575136 -1.945193
H -1.906655 3.125575 -2.043570
H 5.559258 -0.154022 1.427721
H 3.633771 -3.127665 -2.113971
H 6.980560 -1.979542 0.407854
H 5.999307 -3.455235 -1.384999
H 0.185781 -1.827803 -1.984629
H 1.656269 -2.133570 -2.996996
H 1.291419 -3.202025 -1.582323
H -3.560034 -2.152309 -0.358722
H -4.509046 1.892726 0.863445
H -5.508944 -3.026702 0.989817
H -6.458834 1.037547 2.212287
H -6.955181 -1.422236 2.271589


%chk=000211402-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000211402

0 1
O 3.095950 0.380288 0.931023
O -2.666627 1.776741 -0.667373
O 1.919179 -1.230046 -1.083315
O -1.969772 -0.377374 -1.257504
N -0.024877 2.160687 0.701671
C 2.244610 1.346843 0.166099
C 0.727933 0.958905 0.251119
C 2.329788 2.717726 0.890801
C 0.945619 2.852959 1.603555
C -0.542535 3.049358 -0.365286
C -1.493792 2.368823 -1.359620
C 3.823024 -0.607670 0.242848
C 3.264728 -1.461071 -0.761907
C 5.159097 -0.811321 0.650193
C 4.060131 -2.475805 -1.343900
C -2.763572 0.383415 -0.643353
C 5.947202 -1.835966 0.077792
C 5.398337 -2.663049 -0.925507
C -3.926699 -0.078607 0.168217
C 1.235088 -2.169869 -1.976054
C -4.204568 -1.469888 0.205334
C -4.741692 0.826294 0.896649
C -5.291635 -1.952389 0.962171
C -5.828386 0.338588 1.652581
C -6.106054 -1.048903 1.686396
H 2.624166 1.384233 -0.869922
H 0.332896 0.546468 -0.683573
H 0.641218 0.167859 1.017880
H 2.463304 3.531624 0.154262
H 3.186285 2.734878 1.584206
H 0.639386 3.896033 1.792769
H 0.967330 2.315741 2.570315
H 0.258539 3.518676 -0.999112
H -1.079817 3.878503 0.132634
H -0.998230 1.577604 -1.947683
H -1.908676 3.129151 -2.043700
H 5.557077 -0.154241 1.430124
H 3.636356 -3.128853 -2.113359
H 6.980135 -1.979240 0.411748
H 6.001279 -3.455377 -1.382027
H 0.187924 -1.829704 -1.988209
H 1.659823 -2.135256 -2.998584
H 1.293087 -3.203840 -1.584476
H -3.559001 -2.149241 -0.360866
H -4.509745 1.894080 0.865941
H -5.504852 -3.026419 0.990226
H -6.456443 1.036089 2.217347
H -6.950414 -1.424237 2.275633


