%chk=000180362.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180362

0 1
O -2.521863 0.842646 -0.074083
O -2.703020 -1.391273 0.177586
N 1.154149 0.828743 -1.271085
C 2.443097 0.400706 -0.642136
C 0.169087 0.963277 -0.152133
C 2.479867 1.188796 0.690765
C 1.007010 1.477548 1.048023
C 2.529963 -1.130084 -0.443659
C -0.503801 -0.363835 0.153815
C 1.610888 -1.693935 0.647865
C 0.139695 -1.508271 0.449005
C -1.984326 -0.417711 0.092422
C -3.970820 0.919175 -0.149978
H 3.271204 0.723312 -1.319364
H -0.591381 1.725684 -0.463536
H 3.036084 2.132750 0.554913
H 2.995253 0.631897 1.487152
H 0.709272 0.990072 1.989007
H 0.842044 2.559030 1.189365
H 0.832746 0.166964 -1.982095
H 3.575955 -1.400485 -0.197582
H 2.313181 -1.635472 -1.405293
H 1.879974 -1.234238 1.628760
H 1.834167 -2.776880 0.763425
H -0.450095 -2.423413 0.616045
H -4.144741 1.993610 -0.267494
H -4.408648 0.528907 0.774115
H -4.322841 0.347977 -1.014726


%chk=000180362-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180362

0 1
O -2.587613 0.859268 -0.156245
O -2.734037 -1.416029 0.298239
N 1.207439 0.900484 -1.221444
C 2.483330 0.396702 -0.648905
C 0.204973 0.989953 -0.122207
C 2.565228 1.210930 0.672370
C 1.080843 1.476798 1.087310
C 2.538066 -1.146728 -0.440516
C -0.522643 -0.336312 0.163554
C 1.599065 -1.729846 0.649708
C 0.109702 -1.512631 0.475697
C -2.018266 -0.396736 0.117113
C -4.066699 0.883158 -0.206711
H 3.313831 0.668610 -1.329406
H -0.550371 1.745954 -0.382213
H 3.082145 2.165795 0.478753
H 3.133533 0.672278 1.452411
H 0.801369 0.945485 2.013169
H 0.911999 2.552668 1.260852
H 0.876531 0.387893 -2.050228
H 3.578029 -1.427571 -0.174567
H 2.315444 -1.638682 -1.409202
H 1.897956 -1.308390 1.634773
H 1.789650 -2.816921 0.724762
H -0.541714 -2.380455 0.654452
H -4.323163 1.929685 -0.424189
H -4.488270 0.561142 0.760521
H -4.434257 0.208995 -0.998752


