%chk=000044044.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044044

1 1
 O   -1.238600       2.555800     -3.0000001E-04
 O   -2.077400      -2.722600      1.0000000E-03
 N    3.365600      0.5083000     -1.6000000E-03
 N    5.749200      0.1923000      1.8000000E-03
 C  -0.2909000      0.4063000     -1.3000000E-03
 C  -0.5101000     -0.9728000     -1.1000000E-03
 C   -2.805400      0.8061000       0.000000    
 C   -3.024700     -0.5731000      1.9999999E-04
 C   -1.430500       1.346100     -8.9999998E-04
 C   -1.885000      -1.512900     -5.0000002E-04
 C    1.017300      0.9054000     -1.9000000E-03
 C    2.099400      2.4800001E-02 -2.4999999E-03
 C   0.5788000      -1.852900     -1.7000000E-03
 C    1.880700      -1.351400     -2.3000001E-03
 C   -3.894200       1.686100      7.9999998E-04
 C   -4.332600      -1.072200      1.2000001E-03
 C   -5.196100       1.184600      1.8000000E-03
 C   -5.414800     -0.1916000      1.9000000E-03
 C    4.479800     -0.2348000      5.0000002E-04
 C    6.869000     -0.7617000      4.1999999E-03
 C    6.060500       1.630200      6.0000003E-04
 H    1.202900       1.976800     -1.7000000E-03
 H   0.4333000      -2.930000     -1.6000000E-03
 H    2.668300      -2.094000     -2.9000000E-03
 H   -3.750300       2.763300      6.9999998E-04
 H   -4.529800      -2.140900      1.4000000E-03
 H    3.486100       1.517200     -2.0000001E-03
 H   -6.040400       1.867900      2.4999999E-03
 H   -6.429300     -0.5795000      2.6000000E-03
 H    4.396800      -1.304800      1.7000000E-03
 H    7.478100     -0.6006000     -0.8899000    
 H    6.507700      -1.794100      5.7000001E-03
 H    7.476900     -0.5977000      0.8985000    
 H    7.144000       1.782700      1.5000000E-03
 H    5.637100       2.094000      0.8961000    
 H    5.638900       2.091900     -0.8968000    


%chk=000044044-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000044044

1 1
O -1.110410 2.570398 0.000489
O -2.220464 -2.837169 -0.000992
N 3.433695 0.368047 -0.000183
N 5.805917 0.244557 0.001532
C -0.295727 0.308406 -0.000752
C -0.575922 -1.082945 -0.001109
C -2.796370 0.829284 -0.000036
C -3.081149 -0.573387 -0.000376
C -1.398801 1.332729 -0.000789
C -1.990497 -1.588597 -0.001451
C 1.041403 0.758920 -0.000430
C 2.096515 -0.173774 -0.000515
C 0.497005 -2.009289 -0.001241
C 1.830330 -1.568876 -0.000998
C -3.863436 1.762194 0.000987
C -4.427223 -1.014171 0.000303
C -5.198975 1.312243 0.001648
C -5.481123 -0.077617 0.001308
C 4.590350 -0.320793 0.001427
C 7.035413 -0.590372 0.003408
C 5.974113 1.719816 -0.000229
H 1.206181 1.844579 -0.000110
H 0.254825 -3.076669 -0.001639
H 2.630659 -2.315519 -0.001352
H -3.622220 2.829660 0.001221
H -4.621426 -2.091194 0.000017
H 3.468327 1.393879 -0.001092
H -6.019948 2.036001 0.002425
H -6.519411 -0.423935 0.001830
H 4.537679 -1.409582 0.002767
H 7.635457 -0.371852 -0.895966
H 6.773185 -1.659624 0.004884
H 7.634519 -0.369189 0.902755
H 7.046589 1.958278 -0.000272
H 5.525403 2.169989 0.904678
H 5.525836 2.167773 -0.906448


