%chk=000268566.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268566

0 1
O 7.582549 0.553447 0.817357
O -3.764833 -0.240549 3.578793
O 7.796147 -1.485406 -0.137528
O -7.150038 -0.098222 -1.796239
N -4.925395 -0.190940 -0.364350
N -1.749273 -0.326590 1.520578
N -2.686709 -0.281602 -1.160939
N -5.423048 -0.173244 2.006309
N -7.208224 -0.099622 0.494124
N 1.398377 -0.452544 -0.161656
C -3.552513 -0.247859 -0.087621
C -3.075480 -0.269724 1.260188
C -5.809482 -0.156409 0.746979
C -0.898444 -0.360309 0.470367
C -4.048931 -0.229542 2.414290
C 2.810924 -0.489174 0.034997
C -1.374209 -0.336759 -0.880920
C 5.595717 -0.526644 0.179842
C 0.545372 -0.421788 0.808201
C 3.516205 -1.619363 -0.424384
C 3.495900 0.620038 0.567306
C 4.905973 -1.632431 -0.349124
C 4.888100 0.597636 0.632034
C 7.073153 -0.588998 0.237961
C -7.828822 -0.072690 -0.789639
C 9.037536 0.670361 0.926838
C -9.318520 -0.013115 -0.743848
C 9.622814 1.063976 -0.412992
H -5.262054 -0.175633 -1.352023
H -0.670905 -0.363277 -1.731765
H 0.762311 -0.444256 1.893207
H -7.787007 -0.077606 1.351743
H 2.975254 -2.468062 -0.842189
H 2.945344 1.493911 0.910817
H 5.473134 -2.500695 -0.700914
H 5.437160 1.452969 1.038488
H 9.122522 1.462978 1.692301
H 9.440062 -0.287541 1.302371
H -9.730510 0.004904 -1.770632
H -9.695391 0.890169 -0.238280
H -9.766426 -0.884936 -0.240960
H 10.688013 1.308788 -0.329970
H 9.528225 0.244857 -1.142483
H 9.109224 1.935699 -0.838138


%chk=000268566-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268566

0 1
O 7.578502 0.400307 0.974815
O -3.577153 0.789897 3.432972
O 7.835417 -1.437118 -0.445265
O -7.233975 -0.634412 -1.674735
N -4.976665 -0.314937 -0.286854
N -1.708378 0.034037 1.366399
N -2.823536 -0.699594 -1.169111
N -5.376964 0.415161 1.981322
N -7.179318 0.055004 0.553996
N 1.371875 -0.675233 -0.397177
C -3.599350 -0.326772 -0.103366
C -3.056420 0.044414 1.170584
C -5.785454 0.056932 0.775356
C -0.918625 -0.336124 0.311065
C -3.982707 0.447255 2.295599
C 2.775178 -0.613009 -0.207234
C -1.487479 -0.700070 -0.953463
C 5.603377 -0.580185 0.038822
C 0.532103 -0.339520 0.551104
C 3.570054 -1.558444 -0.914528
C 3.417272 0.372840 0.601081
C 4.967537 -1.551675 -0.779807
C 4.817508 0.387958 0.718481
C 7.090378 -0.608465 0.137482
C -7.856669 -0.278792 -0.626509
C 9.063226 0.468762 1.132910
C -9.368156 -0.180724 -0.546966
C 9.691747 1.298872 0.009944
H -5.423763 -0.575040 -1.188708
H -0.835324 -0.991260 -1.780846
H 0.826684 -0.065695 1.582357
H -7.703639 0.340112 1.386881
H 3.063712 -2.289235 -1.552177
H 2.818478 1.139666 1.105398
H 5.590954 -2.282158 -1.305095
H 5.318246 1.143601 1.329597
H 9.196434 0.938765 2.120499
H 9.462377 -0.560682 1.141579
H -9.793688 -0.462419 -1.520144
H -9.687151 0.848353 -0.300274
H -9.770151 -0.856825 0.229512
H 10.776590 1.411157 0.193268
H 9.557435 0.803104 -0.965853
H 9.243282 2.306392 -0.034411


