%chk=000078857.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078857

0 1
 O    3.766700      0.6040000      1.2200000E-02
 N   0.5601000     -0.8682000     -1.5000000E-03
 N  -0.2279000       1.796100     -2.4999999E-03
 N    3.163800      -1.608500     -3.0000000E-03
 C  -0.7434000     -0.5386000     -3.9999999E-04
 C   -1.142500      0.8105000     -6.9999998E-04
 C   -1.718300      -1.533500      1.2000001E-03
 C    1.459200      0.1324000     -3.1999999E-03
 C   -2.501800       1.115000      5.0000002E-04
 C    1.070800       1.445600     -3.5999999E-03
 C   -3.076000      -1.218100      2.4000001E-03
 C   -3.469400      0.1118000      2.2000000E-03
 C    2.858600     -0.2485000     -3.5999999E-03
 H   -1.423700      -2.581100      1.5000000E-03
 H   -2.824500       2.154200      1.9999999E-04
 H    1.771800       2.271700     -4.9999999E-03
 H   -3.819600      -2.009100      3.5999999E-03
 H   -4.523700      0.3710000      3.1999999E-03
 H    2.442400      -2.322600     -8.1000002E-03
 H    4.127000      -1.927000      3.1000001E-03


%chk=000078857-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000078857

0 1
O 3.842953 0.651836 -0.001733
N 0.582976 -0.919960 -0.000299
N -0.220017 1.846203 -0.000565
N 3.200481 -1.602748 -0.000836
C -0.760267 -0.574401 0.000096
C -1.163034 0.820563 -0.000016
C -1.757700 -1.597907 0.000700
C 1.476115 0.093193 -0.000810
C -2.552839 1.148982 0.000467
C 1.073353 1.474158 -0.000989
C -3.110044 -1.247520 0.001142
C -3.508853 0.129523 0.001025
C 2.950458 -0.251283 -0.001486
H -1.429164 -2.641919 0.000789
H -2.828783 2.207877 0.000371
H 1.840821 2.253124 -0.001562
H -3.877712 -2.028606 0.001582
H -4.575261 0.378920 0.001389
H 2.404575 -2.244788 0.000052
H 4.161544 -1.938148 -0.000817


