%chk=000281985.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281985

0 1
O 0.421301 -2.216063 -1.126937
O -2.184406 0.636096 -0.074136
O -0.122154 2.183500 0.257138
O 3.926562 1.525045 -0.739964
O -0.415588 -4.248910 -0.698352
O -4.033956 -0.176180 0.926948
O 5.733963 0.166728 -0.656144
C -0.515731 -0.951124 0.686138
C -1.381783 0.239178 1.084691
C 0.162565 -0.823075 -0.718297
C -0.626965 1.557339 1.443743
C -1.195950 -2.292386 0.591303
C 1.395690 -0.003553 -0.624457
C 0.487972 1.347296 2.446003
C 2.499344 -0.258460 0.091779
C -0.422525 -3.079492 -0.428714
C 3.386672 0.912187 0.482042
C 2.561935 2.048953 1.115556
C 1.805132 1.560773 2.309844
C -2.265166 -2.750818 1.230900
C -0.046757 0.868082 3.769728
C 2.910470 -1.585231 0.621048
C -3.542128 0.349281 -0.048237
C -4.196621 0.773971 -1.308842
C 5.114239 1.028571 -1.233700
C -3.347878 1.495281 -2.299195
C -5.501577 0.477217 -1.461622
C 5.439581 1.732073 -2.504205
C -6.321987 0.816749 -2.650369
H 0.295455 -1.040403 1.465991
H -2.067288 -0.045664 1.922345
H -0.547212 -0.438561 -1.484651
H -1.373748 2.276910 1.873261
H 1.266192 0.997539 -1.065282
H 4.243462 0.603095 1.121118
H 1.880772 2.487212 0.345250
H 3.234980 2.882210 1.403747
H 2.460006 1.367080 3.168934
H -2.844907 -2.159600 1.933864
H -2.654295 -3.753812 1.080079
H -0.368154 -0.181051 3.721262
H -0.904134 1.464669 4.109525
H 0.703820 0.928080 4.570589
H -0.828228 2.185726 -0.436338
H 2.834636 -1.643492 1.713472
H 3.959904 -1.801483 0.353388
H 2.309600 -2.404433 0.190723
H -3.846418 1.602415 -3.273810
H -3.097811 2.505894 -1.944728
H -2.398823 0.964425 -2.475026
H -6.042134 -0.057085 -0.666834
H 4.748634 2.564205 -2.713430
H 5.385034 1.033977 -3.355697
H 6.464079 2.134300 -2.478621
H -6.828138 -0.075337 -3.052096
H -5.737895 1.256065 -3.473748
H -7.109541 1.542086 -2.389780


%chk=000281985-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281985

0 1
O 0.720436 -2.273413 -1.274228
O -2.227964 0.508637 -0.263387
O -0.173256 2.257441 0.095389
O 4.198597 1.661979 -0.619702
O -0.367885 -4.324001 -1.052146
O -4.079950 0.083892 1.100209
O 5.767245 -0.064851 -0.544805
C -0.408819 -0.996818 0.451217
C -1.313081 0.172037 0.870305
C 0.427251 -0.841615 -0.867100
C -0.640410 1.532664 1.278463
C -1.110295 -2.330366 0.232863
C 1.653148 0.008713 -0.694325
C 0.430042 1.389870 2.360537
C 2.667499 -0.174627 0.194115
C -0.276913 -3.124371 -0.735167
C 3.505642 1.050604 0.568628
C 2.603512 2.188696 1.126481
C 1.758333 1.703380 2.291029
C -2.254600 -2.824735 0.764545
C -0.156122 0.892254 3.680366
C 2.966827 -1.437085 0.970947
C -3.624019 0.416798 -0.021978
C -4.402749 0.754726 -1.249287
C 5.320671 0.969442 -1.091375
C -3.645236 1.113443 -2.511247
C -5.766382 0.698151 -1.121672
C 5.869711 1.630241 -2.336755
C -6.803825 0.973037 -2.173888
H 0.322353 -1.128191 1.275375
H -1.943727 -0.155561 1.717325
H -0.216254 -0.433219 -1.667384
H -1.473621 2.119768 1.733039
H 1.595788 0.975606 -1.204579
H 4.289557 0.758040 1.292557
H 1.963955 2.562719 0.315406
H 3.261203 3.012216 1.466033
H 2.322658 1.556782 3.227052
H -2.885090 -2.252913 1.453922
H -2.582562 -3.833472 0.487398
H -0.550711 -0.140608 3.602510
H -0.999716 1.527911 4.014283
H 0.605076 0.893373 4.478124
H -0.916185 2.220481 -0.563393
H 2.783578 -1.297845 2.056458
H 4.040754 -1.677461 0.855767
H 2.385464 -2.300348 0.612999
H -4.326537 1.277976 -3.360708
H -3.048684 2.034468 -2.372207
H -2.936962 0.312350 -2.787205
H -6.149318 0.412750 -0.130371
H 5.738154 2.722749 -2.296276
H 5.317744 1.254233 -3.217928
H 6.932352 1.371481 -2.457284
H -7.435437 0.076196 -2.329343
H -6.380916 1.268784 -3.146982
H -7.488224 1.775607 -1.835421


