%chk=000246484.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246484

0 1
O 3.848490 -1.060830 0.253040
O -1.627901 2.311392 -1.528429
O 5.822956 -0.344035 0.847038
O -5.697638 -0.063774 1.318270
C -0.381774 -0.636234 0.156079
C 0.456505 0.607628 -0.243314
C 1.918616 0.442937 0.227173
C -1.862042 -0.521462 -0.344296
C 2.532425 -0.843910 -0.370187
C 0.271488 -1.939652 -0.346653
C -0.171424 1.863365 0.387698
C 1.732895 -2.073028 0.085737
C -2.459376 0.817215 0.081164
C -1.607960 2.063177 -0.104540
C 2.827116 1.629636 -0.121090
C -2.667546 -1.686766 0.297393
C -1.963599 -0.586366 -1.876331
C 2.779830 -0.821218 -1.874081
C 4.230609 1.411078 0.445036
C -4.179706 -1.513202 0.178486
C -3.698663 0.949809 0.572868
C 4.707069 -0.019119 0.513804
C -4.629927 -0.189830 0.758825
H -0.410907 -0.678173 1.274211
H 0.433449 0.720460 -1.355173
H 1.914735 0.325887 1.342361
H 0.203286 -1.994227 -1.452926
H -0.295423 -2.814089 0.029817
H 0.436409 2.757018 0.148795
H -0.165570 1.786443 1.493161
H 1.818210 -2.186319 1.184912
H 2.182429 -2.996506 -0.329077
H -2.069389 2.950111 0.392470
H 2.407564 2.572637 0.281766
H 2.872876 1.770306 -1.220081
H -2.397940 -1.779600 1.368926
H -2.371373 -2.644435 -0.173591
H -1.485424 -1.481945 -2.283274
H -3.008583 -0.584106 -2.207666
H -1.491013 0.294460 -2.341754
H 3.372387 -1.696409 -2.177940
H 1.842263 -0.840998 -2.440612
H 3.345032 0.062998 -2.189976
H 4.295524 1.822680 1.478573
H 4.976622 1.998298 -0.134537
H -4.710666 -2.347116 0.681774
H -4.503180 -1.561178 -0.883042
H -4.121659 1.915722 0.857902
H -1.134103 3.128970 -1.734207


%chk=000246484-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246484

0 1
O 3.943619 -1.070952 0.262603
O -1.658442 2.370685 -1.606753
O 6.005989 -0.264650 0.796882
O -5.795214 0.001932 1.356725
C -0.380937 -0.641449 0.074420
C 0.471393 0.615985 -0.292935
C 1.941286 0.447691 0.200220
C -1.896004 -0.543153 -0.380982
C 2.581955 -0.846584 -0.371929
C 0.295921 -1.952611 -0.407446
C -0.180468 1.872249 0.328271
C 1.758885 -2.066934 0.073491
C -2.474476 0.811072 0.059029
C -1.632075 2.061220 -0.148208
C 2.866455 1.651632 -0.082669
C -2.693482 -1.694393 0.313536
C -2.044954 -0.656491 -1.933591
C 2.829378 -0.834736 -1.894610
C 4.260022 1.422131 0.546658
C -4.225735 -1.523116 0.248890
C -3.714865 0.946068 0.623273
C 4.817833 -0.006265 0.514347
C -4.665843 -0.173364 0.807156
H -0.400234 -0.678070 1.189113
H 0.472873 0.745945 -1.394470
H 1.900760 0.306868 1.304626
H 0.265712 -2.010655 -1.511564
H -0.264704 -2.827647 -0.032436
H 0.387364 2.788198 0.074689
H -0.173780 1.782713 1.434998
H 1.795070 -2.125742 1.178539
H 2.225920 -2.989905 -0.316113
H -2.098653 2.901995 0.406099
H 2.448023 2.582289 0.339001
H 2.952553 1.813682 -1.173605
H -2.388597 -1.744620 1.378857
H -2.421194 -2.661273 -0.147235
H -1.743809 -1.660172 -2.283062
H -3.094569 -0.493966 -2.234495
H -1.446946 0.109550 -2.452186
H 3.288142 -1.792496 -2.194135
H 1.892149 -0.706248 -2.462620
H 3.520926 -0.027548 -2.191134
H 4.228310 1.685962 1.623071
H 5.028003 2.077384 0.099702
H -4.747452 -2.323615 0.802577
H -4.578888 -1.582970 -0.800698
H -4.082893 1.932624 0.935061
H -1.258327 3.269449 -1.734456


