%chk=000272518.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272518

0 1
O 4.737099 -0.642304 0.018800
O -2.635030 -0.470089 -2.951804
O -2.587627 -2.860019 -1.326906
O 3.141361 0.726673 0.863001
N 0.599972 -0.508553 1.335337
C -0.441885 -0.591976 0.408482
C -1.200687 0.667881 0.141616
C 1.554637 -1.626764 1.509462
C -2.100244 0.693739 -0.946024
C 2.660906 -1.633457 0.442020
C -0.829678 -1.765521 -0.169150
C -1.068322 1.811705 0.938710
C -2.286418 -0.521289 -1.800256
C -1.953416 -1.862713 -1.084587
C -2.823278 1.852610 -1.241626
C -1.805865 2.966503 0.647529
C -2.678077 2.991948 -0.441710
C 3.480674 -0.374508 0.484970
C 5.691374 0.467611 -0.090322
C 5.374593 1.295788 -1.315681
H 1.999523 -1.525566 2.528184
H 1.013408 -2.602896 1.493694
H 1.038157 0.415972 1.473857
H 3.311709 -2.528202 0.559782
H 2.220396 -1.740176 -0.577633
H -0.348599 -2.715099 0.058500
H -0.399076 1.818934 1.800598
H -3.499592 1.858454 -2.101705
H -1.694110 3.849254 1.278453
H -3.246339 3.893532 -0.670465
H 5.653819 1.053188 0.845188
H 6.641969 -0.091590 -0.171197
H 6.159930 2.036214 -1.513009
H 5.275238 0.671335 -2.213557
H 4.429079 1.845880 -1.195752


%chk=000272518-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272518

0 1
O 4.782242 -0.664803 -0.025714
O -3.712746 -0.599568 -2.345525
O -2.273410 -2.980080 -1.832953
O 3.274382 0.545772 1.276899
N 0.614547 -0.556985 1.182863
C -0.444108 -0.611089 0.299581
C -1.184010 0.662423 0.048529
C 1.510284 -1.674095 1.505383
C -2.287557 0.660596 -0.859015
C 2.725730 -1.753623 0.550679
C -0.829422 -1.793515 -0.335296
C -0.833340 1.885649 0.678111
C -2.731590 -0.595055 -1.551690
C -1.940684 -1.891667 -1.257750
C -2.999465 1.855844 -1.121146
C -1.547806 3.073288 0.409153
C -2.634907 3.063599 -0.494831
C 3.587898 -0.503143 0.654335
C 5.717865 0.509999 -0.060204
C 5.377452 1.430485 -1.234066
H 1.867427 -1.531390 2.540697
H 0.949180 -2.621773 1.480260
H 0.979661 0.351529 1.474898
H 3.347806 -2.639500 0.774469
H 2.388216 -1.864806 -0.497366
H -0.284767 -2.727783 -0.170356
H -0.007511 1.944558 1.394884
H -3.838539 1.803502 -1.822762
H -1.255725 4.003565 0.907876
H -3.188861 3.984837 -0.701947
H 5.647805 1.038660 0.906206
H 6.708476 0.042118 -0.171132
H 6.126126 2.241698 -1.297243
H 5.390731 0.875890 -2.187814
H 4.384223 1.891365 -1.101210


