%chk=000219312.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219312

0 1
O -3.072293 -1.243579 -0.043721
O 3.113718 -2.472749 -0.192267
N 1.254443 2.228299 0.050603
C 0.356380 -0.072664 -0.040990
C 0.183932 1.345121 0.026443
C 1.705817 -0.565706 -0.084097
C -0.791592 -0.903937 -0.061565
C -2.051055 -0.325493 -0.016267
C -1.137198 1.904419 0.072000
C -2.238571 1.089263 0.051301
C 2.754917 0.324402 -0.059646
C 2.484618 1.731474 0.009010
C 1.985513 -2.032659 -0.155035
C -4.436908 -0.758902 0.003418
H -0.697237 -1.987217 -0.112354
H -1.232291 2.993073 0.123269
H -3.240249 1.509328 0.085484
H 3.788967 -0.031836 -0.092151
H 3.317378 2.446179 0.029184
H 1.101310 -2.692272 -0.171506
H -5.005134 -1.699134 -0.028877
H -4.653098 -0.142657 -0.873792
H -4.620266 -0.224854 0.939956


%chk=000219312-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219312

0 1
O -3.132949 -1.269470 -0.042031
O 3.249319 -2.474737 -0.194088
N 1.251052 2.245701 0.051201
C 0.368626 -0.095667 -0.042779
C 0.193269 1.350040 0.026173
C 1.733690 -0.583129 -0.085578
C -0.789925 -0.923808 -0.062870
C -2.073426 -0.357271 -0.017086
C -1.129308 1.892059 0.071190
C -2.250314 1.064647 0.050563
C 2.785875 0.348254 -0.058533
C 2.504054 1.742403 0.009445
C 2.067989 -2.031488 -0.157096
C -4.503412 -0.746348 0.005111
H -0.724726 -2.013747 -0.113156
H -1.222417 2.980873 0.122213
H -3.251554 1.503034 0.085749
H 3.817011 -0.018673 -0.090578
H 3.319823 2.473580 0.030630
H 1.211210 -2.743192 -0.177491
H -5.146356 -1.637691 -0.023044
H -4.719137 -0.103781 -0.869680
H -4.687293 -0.183691 0.940134


