%chk=000208131.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208131

0 1
O 4.093607 1.753613 -0.060735
O -1.594643 -1.279358 -0.557850
O 2.745160 -2.563303 0.811949
N -2.833145 0.644591 -0.931647
N 1.860714 1.259228 -0.305277
N 3.451129 -0.431616 0.389508
N -0.493669 0.783482 -0.523935
C -4.725352 -0.132228 0.565116
C -4.117568 -0.104149 -0.857970
C -5.170919 1.263286 1.012321
C -5.902403 -1.111920 0.585607
C 0.812423 0.308679 -0.233900
C 3.228419 0.899843 0.012780
C -1.653209 -0.071686 -0.635806
C 1.092541 -0.975599 0.131596
C 2.409488 -1.450333 0.471510
C 1.632392 2.668289 -0.711775
C 4.856163 -0.799036 0.714584
H -3.943976 -0.505154 1.275992
H -3.944365 -1.148133 -1.217287
H -4.815437 0.372776 -1.581175
H -5.900224 1.700625 0.321238
H -5.652647 1.222357 1.997949
H -4.330444 1.957081 1.100063
H -6.699149 -0.815543 -0.105232
H -6.348316 -1.172762 1.585803
H -5.587617 -2.127405 0.315131
H -2.906383 1.627530 -0.675108
H -0.593275 1.766850 -0.786363
H 0.303681 -1.744412 0.174582
H 1.222969 2.728746 -1.733113
H 2.604623 3.214917 -0.721796
H 0.980820 3.191829 0.005821
H 5.514549 -0.624156 -0.152919
H 4.901918 -1.871906 0.987164
H 5.227944 -0.200224 1.562873


%chk=000208131-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208131

0 1
O 4.089448 1.852702 -0.124653
O -1.634694 -1.426478 -0.257121
O 2.969914 -2.597111 0.842113
N -2.771176 0.550712 -0.754357
N 1.840574 1.199656 -0.303475
N 3.533715 -0.365863 0.354771
N -0.442291 0.612630 -0.509186
C -4.832420 -0.145867 0.563293
C -4.090126 -0.106552 -0.799612
C -5.114419 1.274048 1.105621
C -6.140901 -0.953603 0.406326
C 0.862247 0.188267 -0.202771
C 3.219104 0.937681 -0.026703
C -1.623557 -0.185336 -0.482924
C 1.206435 -1.096316 0.174132
C 2.576064 -1.447906 0.482403
C 1.510993 2.583449 -0.695272
C 4.957243 -0.643862 0.645843
H -4.174110 -0.677772 1.278507
H -3.924221 -1.138671 -1.154077
H -4.713725 0.420504 -1.548356
H -5.758764 1.843866 0.406782
H -5.638712 1.225662 2.077223
H -4.181621 1.847472 1.265835
H -6.823094 -0.469067 -0.319600
H -6.675779 -1.026502 1.370436
H -5.939564 -1.981730 0.053165
H -2.740557 1.569574 -0.806771
H -0.546192 1.577775 -0.823459
H 0.446257 -1.871208 0.237466
H 1.096301 2.629541 -1.720601
H 2.457677 3.144898 -0.684126
H 0.817844 3.055627 0.026446
H 5.575024 -0.434654 -0.242948
H 5.023965 -1.706134 0.922930
H 5.308917 -0.004635 1.472418


