%chk=000228831.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228831

0 1
O -1.226449 -1.570938 -0.000508
O 3.331931 -2.660408 -0.000673
O -5.691471 -0.489746 0.000296
N -0.525547 1.226517 0.000234
N -3.468516 -1.017494 -0.000145
N -4.210119 1.336212 0.000697
C 1.847235 0.677481 -0.000310
C 0.411589 0.312300 -0.000165
C 0.130672 -1.143546 -0.000451
C 2.831595 -0.335480 -0.000624
C 1.039422 -2.123980 -0.000764
C 2.487373 -1.791154 -0.000948
C -1.850035 0.788608 0.000303
C -2.177032 -0.582918 -0.000097
C 2.238714 2.024488 -0.000130
C 4.188544 0.016996 -0.000730
C 3.595840 2.361395 -0.000257
C 4.571567 1.360818 -0.000566
C -2.947385 1.722187 0.000872
C -4.593215 -0.013536 0.000027
H 0.787194 -3.185692 -0.000990
H 1.480620 2.812170 0.000105
H 4.943299 -0.777456 -0.001009
H 3.891127 3.411741 -0.000141
H -3.689097 -2.021206 -0.000390
H 5.628802 1.625656 -0.000695
H -2.733358 2.805985 0.000960


%chk=000228831-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228831

0 1
O -1.243459 -1.571788 -0.000343
O 3.409019 -2.722168 -0.000814
O -5.775611 -0.458473 0.001115
N -0.527602 1.214045 -0.000284
N -3.496003 -0.966238 0.000147
N -4.252160 1.359973 0.000582
C 1.851815 0.655719 -0.000563
C 0.431752 0.276187 -0.000607
C 0.139849 -1.166206 -0.000645
C 2.865118 -0.353831 -0.000879
C 1.085333 -2.153842 -0.000955
C 2.515670 -1.809439 -0.001567
C -1.853477 0.788458 -0.000075
C -2.196355 -0.581428 -0.000097
C 2.228635 2.026758 -0.000112
C 4.231157 0.023523 -0.000694
C 3.587724 2.385874 0.000054
C 4.593673 1.382875 -0.000232
C -2.961038 1.707566 0.000276
C -4.611423 -0.000428 0.000408
H 0.810266 -3.212007 -0.000899
H 1.440020 2.784518 0.000130
H 4.981987 -0.772848 -0.000972
H 3.871449 3.443563 0.000416
H -3.753382 -1.960423 0.000192
H 5.650629 1.669193 -0.000108
H -2.730286 2.779866 0.000428


