%chk=000239641.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239641

0 1
O 0.044173 0.568290 -0.878294
O -2.181264 0.288344 -0.287038
O 2.031773 0.634174 0.207084
C -0.930854 2.780926 0.703215
C -1.497899 2.501002 -0.692673
C 0.529700 2.333079 0.791683
C -1.276377 1.042888 -1.102515
C 0.646061 0.856163 0.416836
C -2.218994 -1.136531 -0.569511
C 2.384120 -0.718844 -0.206389
C -3.063688 -1.721981 0.577291
C 3.923304 -0.708609 -0.199376
C -4.551877 -1.437587 0.356081
C -2.796550 -3.225216 0.701187
C 4.464171 -0.853194 1.225921
C 4.451948 -1.819886 -1.111207
H -1.014197 3.857768 0.940095
H -1.540208 2.244755 1.460496
H -2.582899 2.725354 -0.714084
H -1.017825 3.160277 -1.441981
H 1.168578 2.930850 0.107879
H 0.940201 2.498523 1.804761
H -1.428630 0.827250 -2.179765
H 0.213641 0.139473 1.138839
H -1.184926 -1.522225 -0.574452
H -2.677107 -1.281664 -1.560334
H 1.962113 -0.877838 -1.213890
H 1.950538 -1.440770 0.501657
H -2.744119 -1.212462 1.523150
H 4.251806 0.285034 -0.603562
H -4.716090 -0.361852 0.206265
H -4.944166 -1.956865 -0.523876
H -5.150790 -1.748437 1.217821
H -3.397620 -3.664083 1.506102
H -1.745918 -3.433365 0.929209
H -3.050950 -3.761889 -0.219344
H 5.552882 -0.741201 1.252053
H 4.222300 -1.827494 1.661628
H 4.035520 -0.080863 1.878026
H 4.118428 -2.810417 -0.784094
H 4.123594 -1.681857 -2.147389
H 5.547993 -1.833019 -1.116804


%chk=000239641-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239641

0 1
O 0.025693 0.823793 -1.067966
O -2.138587 0.283241 -0.110898
O 2.112797 0.774636 0.028751
C -0.921955 2.881506 0.782042
C -1.641182 2.600754 -0.557041
C 0.577754 2.512022 0.679903
C -1.404567 1.156835 -1.022270
C 0.728124 1.057195 0.235020
C -2.151981 -1.131418 -0.531772
C 2.408564 -0.645773 -0.255474
C -2.939242 -1.939517 0.512561
C 3.934910 -0.827330 -0.235605
C -4.404335 -1.458256 0.609315
C -2.858844 -3.446875 0.173380
C 4.523954 -0.499622 1.154536
C 4.293385 -2.264570 -0.681812
H -1.032217 3.946729 1.055332
H -1.400269 2.285543 1.582420
H -2.729079 2.770153 -0.467882
H -1.251091 3.276073 -1.342006
H 1.089013 3.150201 -0.064981
H 1.088844 2.646361 1.650683
H -1.737622 0.987240 -2.066541
H 0.279815 0.352515 0.974048
H -1.109704 -1.501240 -0.617877
H -2.634365 -1.213723 -1.532474
H 1.987126 -0.911965 -1.243797
H 1.928629 -1.284279 0.522216
H -2.449893 -1.770292 1.493577
H 4.354285 -0.112166 -0.971716
H -4.445350 -0.377285 0.826629
H -4.937848 -1.638105 -0.344815
H -4.945881 -1.999008 1.407336
H -3.404690 -4.044787 0.925604
H -1.812620 -3.805985 0.148159
H -3.314672 -3.654520 -0.814159
H 5.627647 -0.564695 1.141662
H 4.150982 -1.213240 1.915727
H 4.237111 0.518987 1.467257
H 3.872672 -3.012924 0.017820
H 3.905075 -2.486022 -1.693792
H 5.389510 -2.404187 -0.700398


