%chk=000291908.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291908

0 1
O -1.043310 -0.129049 -0.391994
O 2.111237 2.518426 1.280612
C 1.258633 -0.407880 -0.896038
C 1.700844 0.381896 0.358060
C -0.083879 0.133137 -1.442132
C 1.794889 1.884899 0.020055
C 1.148332 -1.906608 -0.561939
C 3.043488 -0.149777 0.885779
C -0.000478 1.642448 -1.740184
C 0.457192 2.427978 -0.509201
C 2.473431 -2.450197 -0.012309
C 2.946539 -1.646230 1.207513
C -2.430928 -0.040433 -0.798450
C -3.192599 -0.481834 0.451850
C -4.707982 -0.421494 0.233070
C -5.470704 -0.863448 1.479727
H 2.025693 -0.274028 -1.697218
H 0.921046 0.254599 1.152612
H -0.392614 -0.424943 -2.353060
H 2.629448 2.104555 -0.679310
H 0.846465 -2.476948 -1.458167
H 0.335575 -2.051396 0.180330
H 3.326096 0.423640 1.791960
H 3.847751 0.029247 0.149308
H -0.987691 2.015613 -2.071320
H 0.690651 1.813852 -2.586749
H 0.534761 3.503282 -0.741803
H -0.309051 2.331806 0.291069
H 3.248351 -2.421301 -0.801699
H 2.354923 -3.514803 0.262397
H 2.245750 -1.800914 2.050984
H 3.927628 -2.021940 1.551213
H 2.068736 3.486212 1.201351
H -2.603865 -0.709825 -1.657771
H -2.655699 1.001251 -1.083142
H -2.892625 0.155984 1.307870
H -2.876224 -1.505574 0.734565
H -4.992504 -1.062685 -0.624473
H -5.009809 0.608382 -0.042317
H -5.222597 -1.893574 1.761023
H -5.239172 -0.226417 2.341503
H -6.553633 -0.818307 1.319323


%chk=000291908-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291908

0 1
O -1.088076 -0.085258 -0.229470
O 2.380599 2.613888 1.220530
C 1.252890 -0.401428 -0.828996
C 1.822411 0.412376 0.370742
C -0.106803 0.154542 -1.310389
C 1.900173 1.908569 0.012423
C 1.176708 -1.909538 -0.488109
C 3.197203 -0.148176 0.807664
C -0.007317 1.660047 -1.653270
C 0.535980 2.460777 -0.447769
C 2.545481 -2.466588 -0.033532
C 3.113512 -1.652014 1.153384
C -2.487398 -0.036950 -0.668269
C -3.362323 -0.480801 0.509253
C -4.868635 -0.484659 0.159219
C -5.750872 -0.917672 1.349942
H 1.957220 -0.278938 -1.684288
H 1.111823 0.316434 1.217597
H -0.431637 -0.414192 -2.213339
H 2.641075 2.043590 -0.812781
H 0.810255 -2.471416 -1.371890
H 0.426908 -2.048932 0.313733
H 3.567548 0.436176 1.668479
H 3.926780 -0.003025 -0.019000
H -0.994433 2.053323 -1.962402
H 0.667617 1.776097 -2.526443
H 0.628633 3.533717 -0.715989
H -0.173858 2.383227 0.397409
H 3.263204 -2.422161 -0.879908
H 2.445608 -3.534097 0.244989
H 2.454291 -1.786497 2.035843
H 4.113364 -2.034155 1.438245
H 2.366181 3.588674 1.043234
H -2.630086 -0.714684 -1.541719
H -2.766453 0.992426 -0.987217
H -3.175720 0.195208 1.366329
H -3.044455 -1.492818 0.826806
H -5.046137 -1.165302 -0.698635
H -5.172808 0.527762 -0.177500
H -5.483268 -1.935581 1.690252
H -5.620487 -0.232756 2.208720
H -6.822603 -0.921592 1.079019


