%chk=000222801.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222801

0 1
O 0.287007 2.642666 0.195412
O 0.218129 -3.261525 0.357840
O 6.339781 0.427289 -0.112289
O -4.656147 1.968221 -0.113294
C -2.299164 0.274130 0.021634
C -1.494493 -1.022872 0.349372
C -0.070104 -0.931467 -0.198645
C 0.660533 0.272912 0.443370
C -3.722719 -0.141186 0.508739
C 2.081150 0.463662 -0.186534
C -2.407682 -2.152528 -0.153869
C -1.654172 1.428564 0.799351
C -3.844777 -1.623396 0.068178
C -0.189793 1.554367 0.429374
C -2.321912 0.622447 -1.472452
C 2.819424 -0.878171 -0.220968
C 2.867019 1.467700 0.697021
C 0.736944 -2.204527 0.069181
C 1.971225 0.974212 -1.630940
C 2.194546 -2.060279 -0.094538
C 4.298855 -0.834390 -0.467227
C -4.838659 0.780897 0.050284
C 4.344122 1.577199 0.329192
C 5.016069 0.205079 0.412189
C -6.203131 0.176555 -0.126595
H -1.419343 -1.131021 1.462276
H -0.102015 -0.799915 -1.312017
H 0.807305 0.037313 1.532928
H -3.744198 -0.098437 1.628227
H -2.212546 -3.092977 0.392977
H -2.223775 -2.384226 -1.215600
H -1.756735 1.300721 1.892577
H -2.188561 2.382693 0.575616
H -4.432250 -1.719502 -0.859987
H -4.370525 -2.214631 0.835116
H -2.905546 1.539315 -1.648970
H -1.319145 0.809434 -1.870990
H -2.770994 -0.174318 -2.073050
H 2.768236 1.187911 1.762910
H 2.392516 2.472761 0.604411
H 1.467313 1.953346 -1.660031
H 2.958297 1.119830 -2.085298
H 1.407244 0.287981 -2.269866
H 2.734248 -3.009288 -0.105933
H 4.762846 -1.831092 -0.330272
H 4.477825 -0.581379 -1.538566
H 4.474784 1.995907 -0.689979
H 4.862111 2.292055 0.998627
H 5.107025 -0.153589 1.460133
H -6.279719 -0.353484 -1.086118
H -6.459070 -0.537273 0.664458
H -6.978890 0.958009 -0.137261
H 6.898114 -0.363004 -0.002802


%chk=000222801-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222801

0 1
O 0.204463 2.710049 -0.124795
O 0.218803 -3.297057 0.419310
O 6.478198 0.375699 0.221106
O -4.774901 1.970600 -0.132938
C -2.336609 0.270596 -0.094699
C -1.533632 -1.041266 0.174878
C -0.069897 -0.952116 -0.291676
C 0.659777 0.314440 0.297544
C -3.739690 -0.182965 0.411995
C 2.116576 0.490417 -0.262428
C -2.443688 -2.157930 -0.404428
C -1.678169 1.423296 0.704571
C -3.904360 -1.629373 -0.185904
C -0.227739 1.585744 0.248470
C -2.382686 0.651143 -1.600020
C 2.860405 -0.854838 -0.182615
C 2.883920 1.530322 0.633516
C 0.756351 -2.193375 0.092091
C 2.104864 0.962423 -1.752307
C 2.219482 -2.048817 0.027051
C 4.369491 -0.821193 -0.350469
C -4.924170 0.761563 0.196575
C 4.403050 1.601090 0.370301
C 5.053801 0.229468 0.562575
C -6.313514 0.184996 0.448833
H -1.509696 -1.182656 1.279435
H -0.041863 -0.887462 -1.400305
H 0.760327 0.108033 1.391084
H -3.668157 -0.296638 1.519708
H -2.256035 -3.119760 0.094139
H -2.238474 -2.307911 -1.480760
H -1.692231 1.173978 1.787138
H -2.205909 2.379676 0.557964
H -4.455106 -1.593064 -1.143978
H -4.480295 -2.281998 0.493260
H -2.987232 1.563234 -1.732552
H -1.374054 0.861799 -1.999986
H -2.825521 -0.151424 -2.215470
H 2.718979 1.261516 1.698668
H 2.426808 2.520657 0.476743
H 1.636816 1.957245 -1.821347
H 3.129126 1.033244 -2.155673
H 1.545539 0.258945 -2.395700
H 2.790321 -2.979853 0.136439
H 4.788614 -1.829457 -0.167982
H 4.628371 -0.546554 -1.393647
H 4.616230 1.950091 -0.657687
H 4.870801 2.329247 1.057449
H 4.945574 -0.089177 1.623896
H -6.573467 -0.539947 -0.346160
H -6.347969 -0.367078 1.406607
H -7.060465 0.993878 0.453960
H 6.945445 -0.482780 0.385524


