%chk=000213113.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213113

0 1
O -0.379440 0.574101 0.142659
N -1.843219 -1.087988 -0.511991
N -2.633601 1.159398 0.160169
C 0.519541 -0.530742 -0.295929
C 1.331562 0.007922 -1.475444
C 1.364190 -0.907904 0.922906
C 2.302503 1.113322 -1.041235
C 2.335129 0.214018 1.313424
C 3.193346 0.652342 0.119583
C -0.489189 -1.655876 -0.713565
C -1.700080 0.137327 -0.064581
C -4.009397 0.718737 0.501673
H 0.641281 0.404014 -2.247729
H 1.889207 -0.823744 -1.947067
H 1.926881 -1.835740 0.702881
H 0.699009 -1.137663 1.778672
H 1.718913 2.005093 -0.731860
H 2.922407 1.428153 -1.900221
H 2.978860 -0.119144 2.147603
H 1.753984 1.080328 1.691118
H 3.844409 -0.179985 -0.207423
H 3.871799 1.471280 0.422932
H -0.373815 -1.960221 -1.773265
H -0.381339 -2.575694 -0.105246
H -2.278912 1.911515 0.759813
H -4.345797 -0.056210 -0.216210
H -4.686611 1.583300 0.401333
H -4.104122 0.298661 1.515201


%chk=000213113-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213113

0 1
O -0.379908 0.639934 0.162789
N -1.887038 -1.082460 -0.373466
N -2.663719 1.045283 0.452705
C 0.512767 -0.509235 -0.294856
C 1.349218 0.006041 -1.481538
C 1.394891 -0.910944 0.903675
C 2.339604 1.119745 -1.068073
C 2.382652 0.206403 1.311814
C 3.238446 0.663942 0.106053
C -0.532288 -1.617448 -0.693404
C -1.706229 0.139613 0.067539
C -4.087625 0.703464 0.459855
H 0.664976 0.360038 -2.275894
H 1.912063 -0.856826 -1.895623
H 1.962843 -1.819722 0.613292
H 0.742493 -1.192832 1.752061
H 1.761601 2.012627 -0.759821
H 2.957874 1.413473 -1.938178
H 3.032160 -0.148862 2.134987
H 1.806192 1.069503 1.697897
H 3.884489 -0.175582 -0.227420
H 3.914368 1.486651 0.409197
H -0.465768 -1.858807 -1.772594
H -0.354166 -2.552778 -0.128694
H -2.339124 1.931258 0.834717
H -4.241877 -0.138207 -0.233995
H -4.691190 1.564997 0.122537
H -4.440206 0.389329 1.462641


