%chk=000198398.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198398

0 1
O -0.377267 0.883486 -1.061363
O -0.541906 0.251246 1.162083
O -0.589065 -1.349883 -0.509861
C 1.529726 -0.234034 -0.032550
C -0.996246 -0.028191 -0.155560
C 1.074387 0.835609 -1.051338
C 0.899711 0.158271 1.323129
C 0.845978 -1.557017 -0.460023
C 3.050695 -0.396276 0.033037
C -2.527137 0.088313 -0.270346
C 3.791020 0.870329 0.450165
C -3.188229 -0.934745 0.651763
C -2.956058 1.518888 0.051397
H 1.394540 1.855694 -0.783112
H 1.364511 0.600390 -2.087995
H 1.055432 -0.597003 2.110094
H 1.213286 1.154165 1.676572
H 1.125981 -1.882698 -1.475214
H 0.995996 -2.376361 0.261847
H 3.425771 -0.731331 -0.956696
H 3.301121 -1.216594 0.737878
H -2.782515 -0.148404 -1.336732
H 3.616176 1.698698 -0.246486
H 3.493352 1.212385 1.448379
H 4.874491 0.697565 0.479094
H -2.926291 -0.751163 1.702584
H -4.278477 -0.902275 0.565311
H -2.855310 -1.953804 0.410700
H -2.685192 1.793808 1.079783
H -4.037581 1.643945 -0.057415
H -2.459002 2.237288 -0.615126


%chk=000198398-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198398

0 1
O -0.415113 0.922781 -1.100200
O -0.583654 0.262724 1.199677
O -0.623816 -1.392531 -0.533303
C 1.516195 -0.217390 -0.035220
C -1.020859 -0.030487 -0.164880
C 1.073380 0.855961 -1.059489
C 0.898085 0.170928 1.330058
C 0.853308 -1.551846 -0.464916
C 3.053979 -0.391319 0.029387
C -2.547528 0.083685 -0.258089
C 3.857294 0.860116 0.454028
C -3.232579 -0.947625 0.666660
C -3.012098 1.525342 0.047149
H 1.441441 1.861551 -0.783200
H 1.429115 0.604472 -2.077701
H 1.124169 -0.592919 2.099570
H 1.257565 1.156835 1.678201
H 1.206321 -1.864099 -1.467145
H 1.075535 -2.354794 0.265080
H 3.406875 -0.726640 -0.967398
H 3.278997 -1.220561 0.731051
H -2.787493 -0.158603 -1.311267
H 3.706622 1.703608 -0.243190
H 3.581401 1.203450 1.467087
H 4.937630 0.630176 0.465943
H -2.987074 -0.740350 1.723027
H -4.329413 -0.887518 0.544772
H -2.906921 -1.973937 0.428815
H -2.760550 1.799967 1.086702
H -4.107894 1.598676 -0.077293
H -2.531021 2.250649 -0.629915


