%chk=000222205.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222205

0 1
O 3.696719 2.632583 0.867532
O 3.179387 1.908139 -1.193181
O -0.204574 1.216357 2.088396
O 4.134586 -3.099118 -1.565629
O 5.212039 -2.353999 0.251462
O -5.760895 -1.174225 -0.437820
O -4.439585 -1.924067 1.104409
N 0.905697 0.682109 0.166069
N -4.712650 -1.173044 0.184587
C 2.234392 0.769416 0.796824
C 2.977499 -0.576566 0.823084
C 3.195819 -1.196709 -0.557770
C 3.054117 1.794435 0.003221
C -0.257716 0.937914 0.907577
C -1.522801 0.827118 0.111146
C 4.289516 -2.222337 -0.515547
C -2.488513 -0.102099 0.511181
C -1.757402 1.675964 -0.980474
C -3.684782 -0.181841 -0.215770
C -2.961155 1.589890 -1.687546
C -3.932283 0.659894 -1.311883
H 2.111293 1.140413 1.865114
H 3.958641 -0.438796 1.337787
H 2.413037 -1.284205 1.469344
H 3.469728 -0.421030 -1.317164
H 2.260637 -1.656263 -0.947572
H 0.876371 0.404962 -0.812485
H -2.324178 -0.755367 1.378974
H -1.003964 2.411717 -1.274985
H -3.144458 2.254351 -2.534323
H -4.881135 0.580036 -1.856587
H 4.263220 3.314782 0.408146
H 4.848790 -3.792013 -1.599016


%chk=000222205-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222205

0 1
O 4.305333 2.325258 0.695698
O 2.804638 2.600560 -1.056150
O -0.066242 -0.059290 1.894253
O 4.149139 -2.915716 -1.627673
O 4.378639 -2.866448 0.683467
O -5.990858 -1.034970 -0.298368
O -4.615847 -1.870251 1.317951
N 0.973403 0.968342 0.095993
N -4.854080 -1.103595 0.310134
C 2.272848 1.031473 0.777410
C 2.998619 -0.345254 0.876340
C 3.277239 -0.983145 -0.495621
C 3.116615 2.060936 0.032099
C -0.140062 0.456555 0.733730
C -1.450528 0.531277 -0.015058
C 3.978865 -2.321952 -0.367361
C -2.503669 -0.282609 0.463964
C -1.679380 1.384033 -1.127158
C -3.748218 -0.239360 -0.189281
C -2.941595 1.414783 -1.762058
C -3.992139 0.596324 -1.301209
H 2.116622 1.381831 1.816205
H 3.940863 -0.202251 1.432738
H 2.358067 -1.006428 1.483692
H 3.913275 -0.338008 -1.134190
H 2.341135 -1.141203 -1.063687
H 0.928931 1.396065 -0.833130
H -2.341962 -0.924184 1.334786
H -0.894473 2.054985 -1.494694
H -3.106823 2.082560 -2.613126
H -4.979081 0.595870 -1.770761
H 4.842104 2.991904 0.187145
H 4.614018 -3.789693 -1.518980


