%chk=000182346.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182346

0 1
O 2.505223 2.455830 0.344486
O 5.635955 -0.708754 -1.040856
O -4.510036 -0.264901 1.514762
O 0.294821 0.859041 2.133812
C 1.851014 0.097931 0.505460
C 2.801094 1.106520 0.239451
C -3.053892 0.033666 -0.430479
C 2.206637 -1.233860 0.247656
C 0.484268 0.390910 1.026852
C 4.060961 0.807371 -0.284013
C 4.374956 -0.539829 -0.530938
C 3.459352 -1.572231 -0.261283
C -4.307238 -0.281754 0.137946
C -1.901199 0.331432 0.423922
C -0.628878 0.040873 0.110997
C -2.972038 0.100185 -1.832036
C -5.440974 -0.522197 -0.649436
C -4.096002 -0.134179 -2.627239
C -5.328705 -0.439217 -2.037824
C 2.400595 2.976303 1.697656
C 6.083632 -2.057879 -1.325908
C -3.906914 -1.365910 2.240575
H 1.483880 -2.027729 0.452301
H 4.776335 1.598135 -0.501106
H 3.708622 -2.611138 -0.442454
H -2.147026 0.825196 1.379525
H -0.348630 -0.441846 -0.824334
H -2.020243 0.355119 -2.301274
H -6.388787 -0.753596 -0.166613
H -4.013822 -0.073160 -3.711188
H -6.203586 -0.614384 -2.663945
H 3.400013 3.008809 2.139026
H 1.709256 2.377242 2.306028
H 2.003473 3.982835 1.523421
H 5.451110 -2.513572 -2.092874
H 6.109509 -2.651457 -0.407699
H 7.097946 -1.878727 -1.707571
H -2.824318 -1.392968 2.090722
H -4.377701 -2.305321 1.938049
H -4.153362 -1.113892 3.280025


%chk=000182346-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182346

0 1
O 2.725653 2.515818 0.905987
O 5.878249 -0.613106 -0.842201
O -4.560447 0.277199 1.404974
O 0.212884 1.245486 1.734425
C 1.864136 0.279268 0.245503
C 2.944388 1.203132 0.451498
C -3.140828 -0.202725 -0.561207
C 2.177466 -0.965742 -0.362372
C 0.459310 0.573506 0.677571
C 4.255869 0.866282 0.068003
C 4.536984 -0.393638 -0.512504
C 3.489129 -1.324626 -0.729531
C -4.427094 -0.166359 0.067232
C -1.955390 0.217586 0.192228
C -0.644929 0.040848 -0.169233
C -3.088121 -0.613559 -1.926237
C -5.598932 -0.510710 -0.639156
C -4.252907 -0.966907 -2.632078
C -5.515335 -0.910908 -1.990191
C 2.790866 2.725839 2.369929
C 6.229249 -1.897719 -1.456581
C -4.261885 -0.737042 2.436088
H 1.375776 -1.696061 -0.518653
H 5.060901 1.595300 0.194815
H 3.678442 -2.305864 -1.172966
H -2.137017 0.743144 1.140259
H -0.373985 -0.465838 -1.102510
H -2.122636 -0.622150 -2.443832
H -6.560817 -0.447036 -0.120511
H -4.185532 -1.269259 -3.682544
H -6.425840 -1.171603 -2.540700
H 3.770811 2.390774 2.764807
H 1.958958 2.189359 2.856161
H 2.682275 3.812276 2.508445
H 5.709016 -2.034872 -2.424061
H 5.992927 -2.743078 -0.781978
H 7.315008 -1.847543 -1.622699
H -3.223313 -1.109691 2.345356
H -4.967687 -1.587237 2.361337
H -4.390300 -0.223649 3.400728


