%chk=000242691.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242691

0 1
O -3.321899 -1.252141 1.267220
O -4.030660 2.584492 -1.074018
O -2.969037 -2.515425 -0.566604
O -1.864179 3.105834 -0.942061
O 5.626254 -0.618057 0.046443
C -2.241379 -0.149975 -0.591127
C -2.752670 1.081295 0.211528
C -1.922489 1.305711 1.482484
C -0.735245 -0.352340 -0.518347
C -0.445131 1.508865 1.146807
C 0.098469 0.413373 0.273447
C -2.712622 -0.046958 -2.049624
C -2.864886 -1.445202 -0.017386
C 1.523514 0.186267 0.255142
C -0.183833 -1.408185 -1.317584
C -2.742124 2.336784 -0.637361
C 2.055811 -0.850596 -0.562168
C 1.159217 -1.652761 -1.342978
C 2.433450 0.972621 1.025847
C 3.455616 -1.084648 -0.597004
C 3.789864 0.752838 0.994771
C 4.294112 -0.291790 0.168538
C -3.892991 -2.409583 1.937127
C 6.592203 0.156425 0.796256
H -3.822302 0.883629 0.510910
H -2.047884 0.418772 2.144281
H -2.310994 2.170747 2.052441
H 0.135764 1.597009 2.087534
H -0.308930 2.480783 0.608763
H -2.081787 0.648022 -2.620830
H -2.658470 -1.017260 -2.566757
H -3.752848 0.296428 -2.126916
H -0.869577 -2.031840 -1.899826
H 1.572979 -2.456453 -1.949890
H 2.036131 1.771565 1.656534
H 3.866080 -1.876113 -1.219545
H 4.464095 1.363371 1.586019
H -4.101033 3.403849 -1.630504
H -4.364835 -1.968514 2.820408
H -3.083184 -3.096312 2.202259
H -4.620751 -2.903536 1.284411
H 6.418919 0.045412 1.870184
H 6.568435 1.203469 0.481489
H 7.536527 -0.320173 0.500290


%chk=000242691-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242691

0 1
O -3.295329 -1.327575 1.319868
O -4.080302 2.892085 -0.847001
O -3.165247 -2.486223 -0.680127
O -1.797436 2.934605 -1.231013
O 5.706051 -0.644366 0.076104
C -2.296929 -0.153870 -0.606924
C -2.794283 1.121439 0.169881
C -1.962307 1.393619 1.451624
C -0.762860 -0.383063 -0.497282
C -0.459809 1.541203 1.156830
C 0.085751 0.417287 0.288329
C -2.723707 -0.063009 -2.105095
C -2.964279 -1.433842 -0.031930
C 1.515980 0.181375 0.257292
C -0.208852 -1.469171 -1.262899
C -2.781574 2.367340 -0.705303
C 2.059994 -0.907036 -0.531062
C 1.153795 -1.732127 -1.276884
C 2.446401 0.999479 0.977124
C 3.466086 -1.142249 -0.555753
C 3.824423 0.764663 0.941310
C 4.340718 -0.323947 0.168652
C -3.865685 -2.553216 1.935007
C 6.655980 0.192021 0.812190
H -3.845446 0.955801 0.457228
H -2.131596 0.544180 2.134352
H -2.340385 2.304795 1.952805
H 0.078790 1.564396 2.122688
H -0.263115 2.510200 0.657224
H -2.111699 0.693211 -2.623116
H -2.596220 -1.031481 -2.611133
H -3.790419 0.217609 -2.185993
H -0.885974 -2.114684 -1.831385
H 1.551112 -2.569415 -1.861835
H 2.081895 1.846432 1.565760
H 3.877027 -1.966292 -1.147972
H 4.496950 1.419733 1.503231
H -4.033735 3.719240 -1.401508
H -4.071361 -2.272603 2.977411
H -3.135755 -3.377652 1.878309
H -4.788795 -2.848858 1.409520
H 6.466728 0.157834 1.902980
H 6.627221 1.242667 0.462944
H 7.643897 -0.240833 0.596156


