%chk=000200682.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200682

0 1
O -1.689280 1.356221 1.595802
O 4.720207 -1.451225 -0.290662
N 2.293861 -0.089471 0.369748
C 0.097648 1.009649 -0.075280
C -1.429456 0.977876 0.224914
C 0.650638 2.431393 0.125072
C -2.199360 2.031818 -0.598526
C 0.857714 -0.015571 0.797153
C -0.095883 3.441155 -0.754951
C -1.596008 3.431309 -0.435524
C -2.036121 -0.403867 -0.015929
C 2.433431 -0.842934 -0.920753
C 3.122225 -0.753435 1.431638
C -1.761528 -1.110493 -1.195693
C -2.905607 -0.959008 0.932391
C 3.915324 -0.850462 -1.326193
C 4.588779 -0.764446 0.970557
C -2.336334 -2.365495 -1.413638
C -3.478519 -2.214781 0.713928
C -3.192904 -2.921814 -0.458067
H 0.234997 0.734475 -1.151911
H 1.734448 2.439019 -0.105997
H 0.561979 2.724352 1.188920
H -3.255459 2.040969 -0.260020
H -2.212381 1.734345 -1.662826
H 0.345593 -1.003095 0.754946
H 0.824250 0.313109 1.859591
H 0.068726 3.212001 -1.824325
H 0.316757 4.454810 -0.594347
H -1.754501 3.768812 0.610341
H -2.132079 4.149636 -1.081601
H -1.029178 0.967730 2.199454
H 2.054805 -1.885962 -0.856818
H 1.831716 -0.319958 -1.695577
H 3.030030 -0.164051 2.368376
H 2.791647 -1.790291 1.656069
H -1.101378 -0.682999 -1.948684
H -3.140272 -0.395125 1.838530
H 4.109940 -1.509471 -2.189875
H 4.290614 0.168730 -1.526030
H 4.991466 0.258568 0.865608
H 5.231615 -1.365852 1.636394
H -2.118744 -2.909862 -2.330717
H -4.151880 -2.639880 1.456260
H -3.638941 -3.899532 -0.628550


%chk=000200682-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200682

0 1
O -1.643967 1.340233 1.694636
O 4.819769 -1.493234 -0.316084
N 2.339861 -0.117885 0.343971
C 0.119149 1.028649 -0.039919
C -1.414850 0.959339 0.272959
C 0.660081 2.468293 0.142265
C -2.188844 2.032423 -0.543543
C 0.936616 0.023767 0.812267
C -0.111497 3.493363 -0.716057
C -1.616797 3.455903 -0.369781
C -2.043685 -0.422595 -0.006083
C 2.460877 -0.952107 -0.880386
C 3.241385 -0.643728 1.402741
C -1.685899 -1.196754 -1.141694
C -3.070525 -0.913357 0.841834
C 3.921092 -0.975439 -1.360562
C 4.692156 -0.664773 0.894911
C -2.319954 -2.430069 -1.409375
C -3.704791 -2.148206 0.577981
C -3.330413 -2.915727 -0.547695
H 0.236636 0.764242 -1.110905
H 1.738312 2.467145 -0.101321
H 0.559953 2.748867 1.210279
H -3.248989 1.994610 -0.231039
H -2.153462 1.737662 -1.611224
H 0.420810 -0.968407 0.842074
H 0.982350 0.405219 1.852685
H 0.028267 3.260384 -1.793225
H 0.295787 4.509732 -0.552623
H -1.759767 3.773741 0.680074
H -2.184214 4.159438 -1.009755
H -1.242208 0.642231 2.273663
H 2.116354 -2.000691 -0.690055
H 1.827405 -0.528233 -1.681533
H 3.173713 0.014182 2.290025
H 2.951454 -1.679026 1.715674
H -0.910650 -0.842515 -1.831289
H -3.377984 -0.308740 1.701673
H 4.046640 -1.654742 -2.220031
H 4.232763 0.052664 -1.646252
H 5.021736 0.373651 0.674011
H 5.368717 -1.120243 1.636908
H -2.025269 -3.011779 -2.290468
H -4.494927 -2.506919 1.247778
H -3.820597 -3.873672 -0.754311


