%chk=000198461.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198461

0 1
O -0.612894 0.443388 -0.200114
O -3.897444 1.905481 -0.600898
O -4.330699 -1.015539 -0.055095
C -2.891920 0.890529 -0.536706
C -1.547487 1.555323 -0.186380
C 1.553341 -0.429281 -0.077559
C 0.729970 0.723732 -0.012451
C 0.969524 -1.786610 -0.346233
C -3.278264 -0.205328 0.469944
C 2.926151 -0.257283 0.106111
C 1.253371 1.996944 0.223703
C 3.469059 1.013569 0.345675
C 2.636895 2.130132 0.402519
C 1.223784 -2.747155 0.779865
C 1.428041 -4.050408 0.600368
H -2.887728 0.486471 -1.579623
H -1.543706 2.016817 0.814483
H -1.258345 2.298226 -0.951023
H -0.133296 -1.712957 -0.508077
H 1.370621 -2.175192 -1.307770
H -3.586832 0.206255 1.446054
H -2.444800 -0.926151 0.617321
H 3.583615 -1.127043 0.063874
H 0.620089 2.875726 0.269906
H 4.542057 1.122475 0.485750
H 3.058519 3.117675 0.587010
H 1.213514 -2.297277 1.774788
H -4.059969 2.308981 0.276208
H -5.083566 -0.447828 -0.337807
H 1.589971 -4.740348 1.415354
H 1.446227 -4.532021 -0.365798


%chk=000198461-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198461

0 1
O -0.702808 0.344620 -0.212381
O -3.958502 2.026830 -0.881316
O -4.884936 -0.488864 0.123845
C -3.007350 0.912380 -0.639394
C -1.612110 1.485534 -0.354647
C 1.490030 -0.536635 0.187078
C 0.661234 0.613885 0.042622
C 0.890503 -1.935319 0.049428
C -3.554717 0.005320 0.474350
C 2.865859 -0.328392 0.432332
C 1.190505 1.921256 0.147261
C 3.413229 0.972489 0.536655
C 2.571958 2.095243 0.394701
C 1.669061 -3.022571 0.760819
C 2.131146 -4.158749 0.181260
H -3.007000 0.361325 -1.593889
H -1.617642 2.087693 0.582481
H -1.300244 2.135108 -1.196190
H -0.145558 -1.907144 0.441243
H 0.793223 -2.189600 -1.025115
H -3.574008 0.568469 1.437660
H -2.914998 -0.882210 0.598592
H 3.514243 -1.205765 0.536993
H 0.549680 2.800827 0.034346
H 4.483857 1.104363 0.725001
H 2.981946 3.108246 0.472955
H 1.835972 -2.862949 1.837641
H -3.968651 2.620815 -0.084565
H -5.386205 0.275836 -0.266709
H 2.659034 -4.925361 0.759588
H 1.991045 -4.355377 -0.889246


