%chk=000244833.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244833

0 1
O 1.016334 2.656260 -0.421427
O 3.334276 1.751849 0.990941
O 0.456425 1.199361 -2.848509
O 2.288337 -1.472018 -0.306008
O 4.844658 -1.957582 1.052997
N -1.615926 -0.144511 -1.636725
N -0.578024 -0.083416 0.407923
C 1.738532 1.483981 -0.807148
C 2.362592 0.842798 0.451880
C 0.826826 0.547057 -1.632355
C 3.168539 -0.441981 0.155689
C -0.430968 0.122927 -0.919163
C 3.929627 -0.918838 1.404877
C -2.576166 -0.545944 -0.691093
C -1.910918 -0.504709 0.585528
C -3.924221 -0.932548 -0.810268
C -2.612763 -0.858116 1.756469
C -4.582941 -1.272887 0.357574
C -3.935968 -1.236003 1.623867
H 2.535604 1.905832 -1.473462
H 1.586417 0.663964 1.236172
H 1.392022 -0.366549 -1.978395
H 3.869451 -0.312596 -0.703509
H 3.252206 -1.281227 2.196971
H 4.582988 -0.115136 1.808337
H -1.737011 -0.052729 -2.632037
H 0.286773 2.429041 0.208375
H 2.964534 2.668522 1.002771
H 0.218359 2.146299 -2.667966
H 1.560488 -1.638531 0.340577
H -4.415665 -0.960964 -1.777987
H -2.109982 -0.827046 2.721223
H -5.628451 -1.580467 0.319732
H -4.511570 -1.516466 2.506080
H 4.368383 -2.671526 0.569570


%chk=000244833-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244833

0 1
O 1.205628 2.746968 -0.924027
O 3.339888 1.946286 0.769410
O 0.339738 1.223921 -3.008731
O 2.219601 -1.512960 -0.093976
O 4.176367 -2.101483 1.727895
N -1.649307 0.256895 -1.457603
N -0.325111 -0.739699 0.092210
C 1.833200 1.392421 -1.066796
C 2.358314 0.948350 0.314471
C 0.839933 0.479483 -1.839527
C 3.093975 -0.407845 0.330073
C -0.353971 0.005639 -1.032762
C 3.651312 -0.737750 1.733485
C -2.529311 -0.363973 -0.556000
C -1.678700 -0.986751 0.421659
C -3.935101 -0.446539 -0.492401
C -2.239872 -1.712359 1.495566
C -4.478253 -1.175998 0.586491
C -3.645322 -1.797545 1.563448
H 2.692830 1.592821 -1.730137
H 1.502543 0.906137 1.026896
H 1.390781 -0.402187 -2.208166
H 3.929277 -0.387067 -0.393997
H 2.839839 -0.624756 2.488551
H 4.483581 -0.068225 1.997553
H -1.846693 0.740304 -2.335323
H 0.461760 2.684125 -0.265578
H 2.967725 2.846590 0.572806
H 0.441739 2.191861 -2.782829
H 1.253526 -1.354107 0.219877
H -4.581550 0.025018 -1.239257
H -1.599549 -2.190911 2.242325
H -5.565850 -1.268763 0.675748
H -4.111644 -2.354414 2.382979
H 3.531478 -2.627388 1.177168


