%chk=000245363.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245363

0 1
O -2.930332 -0.240260 1.163005
O -2.599163 1.783527 0.166514
N 3.275616 -0.746879 -0.400650
C -3.572173 -0.370376 -0.136208
C -2.021665 0.874542 1.126609
C -3.351088 1.009261 -0.800684
C -0.629678 0.456355 0.733533
C -2.947368 -1.523761 -0.899425
C 0.183007 1.314516 -0.017531
C -0.127950 -0.787180 1.138601
C 1.999156 -0.305909 0.055390
C 1.483278 0.947906 -0.352255
C 1.169807 -1.168869 0.812094
C 4.245591 0.312520 -0.793916
C 3.933669 -1.819450 0.395946
H -4.633173 -0.565301 0.126181
H -2.092270 1.372603 2.112555
H -2.755270 0.968726 -1.725703
H -4.275270 1.585759 -0.957338
H -3.029661 -2.457592 -0.327359
H -3.423406 -1.680226 -1.871999
H -1.872089 -1.359811 -1.066903
H -0.216848 2.277969 -0.343644
H -0.770490 -1.460898 1.710725
H 2.090756 1.630039 -0.941356
H 1.532911 -2.141779 1.133159
H 3.799404 0.948199 -1.579422
H 5.142023 -0.154994 -1.232905
H 4.560184 0.957759 0.041143
H 3.264537 -2.696045 0.459202
H 4.202428 -1.510632 1.418203
H 4.847927 -2.152617 -0.121763


%chk=000245363-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245363

0 1
O -2.897175 -0.252159 1.178953
O -2.615681 1.773798 0.014658
N 3.489565 -0.518782 -0.112215
C -3.693349 -0.353617 -0.088131
C -2.008537 0.921577 1.053673
C -3.140756 0.800428 -0.965787
C -0.579617 0.517384 0.708443
C -3.543950 -1.749399 -0.697956
C 0.311483 1.460367 0.138820
C -0.085841 -0.776038 1.000152
C 2.156762 -0.180523 0.153854
C 1.649479 1.126366 -0.140126
C 1.250597 -1.127246 0.730267
C 4.399633 0.477202 -0.688082
C 3.983712 -1.861317 0.211720
H -4.746037 -0.158798 0.193340
H -2.077980 1.498592 1.992841
H -2.327412 0.439891 -1.627595
H -3.912396 1.320605 -1.553038
H -3.875318 -2.520742 0.018306
H -4.162586 -1.841017 -1.611083
H -2.490517 -1.947952 -0.961964
H -0.057728 2.463749 -0.102936
H -0.767687 -1.512506 1.438802
H 2.300079 1.883116 -0.587569
H 1.588284 -2.139190 0.971573
H 4.050843 0.831092 -1.680212
H 5.396958 0.028775 -0.821883
H 4.511291 1.365337 -0.031937
H 3.430414 -2.649463 -0.339566
H 3.899237 -2.084115 1.295725
H 5.046633 -1.938311 -0.067249


