%chk=000180083.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180083

0 1
O -1.559666 0.844714 0.062299
O -2.182517 -1.828394 -1.308767
O -4.457462 -0.658071 1.205798
O -3.574736 0.539054 -2.172242
O -0.018982 -0.633904 -1.607394
O -4.381910 3.039305 0.855842
O 3.739876 -1.923333 0.957112
O -0.312060 -1.333486 2.943311
N -0.209612 -0.878003 0.671546
N 1.712463 -1.655330 1.911894
C -1.637088 -0.448185 0.704555
C -2.594643 -1.429674 -0.021769
C -3.990562 -0.765268 -0.145470
C -3.913156 0.641042 -0.780768
C -2.799132 1.524718 -0.185873
C 2.077340 -0.790412 -0.422425
C 0.544941 -0.772204 -0.550966
C 2.633692 -1.516436 -1.679752
C -3.272661 2.179772 1.128774
C 2.612771 -1.508945 0.820097
C 0.346660 -1.276148 1.926728
C 2.599793 0.643959 -0.365491
C 2.159218 -2.958761 -1.789279
C 3.985875 0.851736 -0.261960
C 1.737919 1.747750 -0.417702
C 4.501206 2.147870 -0.218366
C 2.261329 3.044410 -0.374384
C 3.639773 3.248815 -0.276223
H -1.975437 -0.302974 1.768380
H -2.664801 -2.388211 0.550017
H -4.667736 -1.427645 -0.729014
H -4.892992 1.172597 -0.691538
H -2.471196 2.277717 -0.946978
H 3.743270 -1.484106 -1.653522
H 2.322698 -0.942341 -2.579888
H -2.453913 2.730956 1.620619
H -3.693373 1.433546 1.837460
H 2.083487 -2.057719 2.789805
H -1.894512 -1.020936 -1.849711
H -5.413064 -0.438145 1.229737
H -4.190906 -0.062098 -2.641539
H 2.474408 -3.568794 -0.934283
H 1.066182 -3.031775 -1.877021
H 2.575372 -3.434880 -2.687559
H 4.665877 -0.003088 -0.203993
H 0.652320 1.625377 -0.497057
H -4.080899 3.863049 0.419005
H 5.577104 2.300216 -0.137782
H 1.585528 3.897820 -0.418986
H 4.042712 4.259842 -0.243779


%chk=000180083-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180083

0 1
O -1.659289 1.090584 -0.051665
O -2.414920 -0.866640 -2.120492
O -4.421056 -0.947487 0.965562
O -3.998678 1.260614 -2.076916
O 0.155937 -1.040805 -1.834434
O -4.598328 1.478383 2.111772
O 3.582882 -1.922141 1.327794
O -0.578313 -0.510933 2.768980
N -0.282482 -0.759505 0.437754
N 1.493137 -1.195889 1.996316
C -1.701755 -0.348137 0.273817
C -2.636376 -1.108076 -0.698213
C -4.070025 -0.563498 -0.396398
C -4.105906 0.976374 -0.651285
C -2.993553 1.734583 0.133329
C 2.106906 -0.945130 -0.398498
C 0.590306 -0.944270 -0.652372
C 2.821180 -1.828853 -1.469846
C -3.260453 1.940862 1.659802
C 2.471779 -1.428496 1.015730
C 0.170372 -0.783271 1.800110
C 2.625512 0.534233 -0.490419
C 2.416446 -3.317219 -1.444651
C 3.998343 0.782201 -0.227833
C 1.781955 1.614951 -0.850983
C 4.521476 2.087534 -0.338545
C 2.313795 2.920244 -0.961187
C 3.681532 3.163122 -0.709002
H -2.158692 -0.506264 1.269115
H -2.604478 -2.189946 -0.458808
H -4.766776 -1.040285 -1.109946
H -5.092265 1.370363 -0.343530
H -2.863302 2.703681 -0.376471
H 3.906879 -1.738250 -1.296046
H 2.599319 -1.388420 -2.456856
H -3.132282 3.003432 1.935219
H -2.545364 1.347303 2.252162
H 1.763015 -1.343978 2.974706
H -1.423828 -0.949773 -2.287009
H -4.704348 -0.137563 1.495762
H -3.330543 0.594568 -2.437559
H 2.654960 -3.787292 -0.473818
H 1.341240 -3.453244 -1.656534
H 2.975078 -3.867218 -2.222612
H 4.655089 -0.040033 0.077149
H 0.715295 1.467488 -1.049149
H -5.283441 2.171945 1.952660
H 5.583078 2.262943 -0.133029
H 1.652003 3.745519 -1.245635
H 4.087737 4.176688 -0.796499


