%chk=000231320.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231320

0 1
O 1.267792 2.271033 -0.701919
O 1.233828 -2.302798 -0.583439
N 1.254583 -0.015813 -0.638921
C 2.727807 -0.034100 -0.922707
C -1.526126 0.021171 -0.008381
C -0.831221 1.255585 -0.195897
C -0.849665 -1.231470 -0.131355
C 3.533792 -0.005870 0.383228
C 0.619317 1.257961 -0.523266
C 0.600530 -1.272328 -0.457685
C -2.910133 0.039552 0.304383
C 5.040041 -0.024793 0.091879
C -1.501037 2.456933 -0.074249
C -1.537157 -2.414831 0.052232
C -3.575851 1.299806 0.424049
C -3.594400 -1.202792 0.489047
C -2.887732 2.475359 0.239182
C -2.923843 -2.396420 0.365699
C 5.859052 0.003182 1.380169
H 2.959876 -0.952997 -1.509362
H 2.973157 0.849347 -1.556510
H 3.259342 -0.873037 1.016083
H 3.272556 0.897290 0.969631
H 5.312965 0.842181 -0.542147
H 5.299742 -0.928092 -0.495272
H -0.964869 3.401872 -0.219326
H -1.015110 -3.373866 -0.043431
H -4.640218 1.308979 0.664626
H -4.658690 -1.183697 0.729379
H -3.391285 3.438204 0.329150
H -3.441566 -3.345732 0.505343
H 5.641503 -0.863073 2.015696
H 6.933622 -0.008692 1.165832
H 5.652097 0.903246 1.970662


%chk=000231320-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231320

0 1
O 1.287848 2.321062 -0.637896
O 1.251874 -2.351822 -0.516829
N 1.247565 -0.015815 -0.599208
C 2.708704 -0.034062 -0.891065
C -1.542702 0.021067 -0.006539
C -0.839481 1.254753 -0.182153
C -0.858683 -1.230852 -0.116574
C 3.561630 -0.008328 0.396876
C 0.617934 1.254098 -0.480498
C 0.598450 -1.268051 -0.414833
C -2.957155 0.039813 0.285213
C 5.073799 -0.021485 0.077166
C -1.520702 2.477341 -0.071069
C -1.558680 -2.435180 0.059108
C -3.622542 1.304443 0.390942
C -3.641909 -1.207007 0.457782
C -2.915393 2.500834 0.215174
C -2.953390 -2.421808 0.346086
C 5.944519 0.001652 1.352405
H 2.913807 -0.954096 -1.462635
H 2.927097 0.853727 -1.506943
H 3.307144 -0.887475 1.019368
H 3.314748 0.900508 0.978583
H 5.322632 0.853521 -0.556971
H 5.315295 -0.924365 -0.519677
H -0.951892 3.402508 -0.210059
H -1.004423 -3.375169 -0.030702
H -4.696179 1.323293 0.612304
H -4.715606 -1.197714 0.679479
H -3.433752 3.461431 0.298061
H -3.486344 -3.368581 0.479881
H 5.734384 -0.877586 1.989953
H 7.021962 -0.008106 1.105263
H 5.742141 0.908752 1.952408


