%chk=000186727.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186727

0 1
O -3.740637 0.927306 0.187840
O -2.442162 -1.582523 0.077089
O 2.640368 -2.729344 -0.065200
O -0.967211 -3.442183 0.752760
C 1.871005 0.848310 0.039134
C 2.601460 2.183529 0.029066
C 0.437025 0.783546 0.111128
C -0.238201 -0.478028 0.137526
C 2.607032 -0.317560 -0.030335
C -0.321381 1.997092 0.138269
C 0.541355 -1.685152 0.104677
C -1.676288 -0.449125 0.161411
C -1.689831 2.015536 0.168371
C 3.343652 2.368927 -1.298721
C 3.546866 2.283487 1.230786
C 1.927781 -1.554836 -0.005159
C -2.383479 0.753511 0.179894
C -2.481306 3.278211 0.201125
C 0.052481 -3.073777 0.189936
C -4.604829 -0.241322 0.212536
H 1.852967 3.021599 0.118541
H 3.690701 -0.292969 -0.099288
H 0.229603 2.945296 0.129848
H 4.140911 1.629885 -1.434163
H 3.806898 3.360731 -1.354902
H 2.661540 2.273637 -2.152760
H 3.011793 2.114491 2.173510
H 4.007736 3.276513 1.286120
H 4.359871 1.550953 1.181096
H -2.918399 3.436930 1.199364
H -1.887554 4.163249 -0.052282
H -3.329393 3.228838 -0.502329
H 0.717761 -3.834973 -0.262027
H -2.144180 -2.290394 0.764084
H 3.615170 -2.576511 -0.151602
H -5.596194 0.221900 0.170790
H -4.449900 -0.800497 1.138995
H -4.407630 -0.875185 -0.660429


%chk=000186727-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186727

0 1
O -3.765248 0.877492 -0.191652
O -2.475731 -1.594018 -0.313113
O 2.745748 -2.805103 0.240692
O -1.109704 -3.598251 0.162334
C 1.892136 0.811485 0.270437
C 2.642529 2.149292 0.306475
C 0.448928 0.760523 0.163822
C -0.247485 -0.522936 0.083720
C 2.621586 -0.381767 0.286906
C -0.299244 1.978789 0.110499
C 0.551933 -1.764865 0.137577
C -1.686075 -0.493517 -0.075216
C -1.690286 2.000973 0.011150
C 2.793414 2.712845 -1.138504
C 4.026022 2.084310 0.996503
C 1.971296 -1.633672 0.217742
C -2.381393 0.753199 -0.057581
C -2.473183 3.295133 -0.026229
C 0.098144 -3.149276 0.178189
C -4.692200 -0.129300 0.369649
H 2.032917 2.866283 0.888015
H 3.714885 -0.354838 0.359929
H 0.222564 2.937079 0.160469
H 3.419721 2.038123 -1.750887
H 3.280760 3.705017 -1.113596
H 1.816326 2.816012 -1.640732
H 3.962189 1.631583 2.002531
H 4.431060 3.106373 1.107121
H 4.760300 1.510621 0.400332
H -3.216834 3.331962 0.790269
H -1.801467 4.165850 0.064620
H -3.047003 3.385488 -0.966293
H 0.904550 -3.897207 0.247166
H -1.997508 -2.515651 -0.117071
H 3.706571 -2.587083 0.327582
H -5.674314 0.369370 0.342550
H -4.415768 -0.373084 1.411757
H -4.684737 -1.048137 -0.232462


