%chk=000126674.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126674

0 1
 O   -4.187400       1.376100     -2.0000001E-03
 O    3.017300       1.911600     -5.0000002E-04
 N   -1.911500      0.8384000      1.3000000E-03
 N    1.875900      -1.392300      2.3000001E-03
 N   -1.159300      -1.430000      2.7000001E-03
 C   0.3766000      0.5593000      2.3000001E-03
 C   9.3000002E-02   1.989700      1.3000000E-03
 C  -0.9261000     -0.1650000      2.6000000E-03
 C   -1.305200       2.119200      7.9999998E-04
 C    1.560100     -5.7200000E-02  1.5000000E-03
 C   -3.271200      0.5629000      9.9999997E-05
 C    2.855000      0.7105000     -6.9999998E-04
 C    3.907700     -0.3210000     -1.5000000E-03
 C    3.254700      -1.561100      3.9999999E-04
 C   -3.573500     -0.8940000       0.000000    
 C   0.9210000       3.099200      7.9999998E-04
 C   -1.902000       3.369700     -6.9999998E-04
 C   -2.513800      -1.820200      1.5000000E-03
 C   0.3256000       4.361900     -5.0000002E-04
 C   -1.072500       4.495400     -1.3000000E-03
 C    5.280100     -0.1896000     -3.0000000E-03
 C    3.988300      -2.728800      1.4000000E-03
 C   -4.902900      -1.330900     -2.0999999E-03
 C   -2.815000      -3.187000      7.9999998E-04
 C    6.023500      -1.370400     -2.6000000E-03
 C    5.384900      -2.626800     -3.0000001E-04
 C   -5.182100      -2.696800     -2.9000000E-03
 C   -4.141100      -3.623100     -1.6000000E-03
 H    1.192200      -2.130500      2.7999999E-03
 H    1.957600       3.311700      4.9000001E-03
 H   -2.976700       3.504300     -1.3000000E-03
 H   0.9407000       5.259100     -9.9999997E-05
 H   -1.514700       5.488400     -2.2000000E-03
 H    5.765400      0.7788000     -4.4000000E-03
 H    3.507000      -3.700600      3.1999999E-03
 H   -5.730000     -0.6265000     -3.3000000E-03
 H   -2.014800      -3.923400      1.7000000E-03
 H    7.109400      -1.323700     -3.8000001E-03
 H    5.988400      -3.531000      3.0000001E-04
 H   -6.212800      -3.039600     -4.6999999E-03
 H   -4.361400      -4.686700     -2.3000001E-03


%chk=000126674-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126674

0 1
O -4.231243 1.376869 -0.000344
O 3.422423 1.984816 0.000752
N -1.914552 0.980394 -0.000558
N 1.760621 -1.176214 -0.001017
N -0.943449 -1.251865 -0.000434
C 0.420541 0.855605 -0.000360
C 0.023630 2.265339 -0.000039
C -0.824332 0.078066 -0.000505
C -1.410413 2.320478 -0.000198
C 1.659711 0.210200 -0.000429
C -3.272058 0.551633 -0.000826
C 3.077284 0.764299 -0.000225
C 3.946762 -0.432970 -0.000086
C 3.108132 -1.587415 -0.000745
C -3.408026 -0.922878 -0.000596
C 0.757075 3.476206 0.000285
C -2.127171 3.526605 -0.000012
C -2.247982 -1.773323 -0.000470
C 0.046785 4.698404 0.000495
C -1.370595 4.724986 0.000350
C 5.349167 -0.559306 0.000483
C 3.649093 -2.885806 -0.000939
C -4.704492 -1.497448 -0.000533
C -2.424713 -3.185221 -0.000338
C 5.907036 -1.858604 0.000306
C 5.061642 -3.001071 -0.000410
C -4.862150 -2.893551 -0.000406
C -3.715682 -3.737174 -0.000314
H 0.885137 -1.739752 -0.001662
H 1.849234 3.447508 0.000336
H -3.218282 3.524826 -0.000145
H 0.604017 5.641167 0.000747
H -1.895455 5.686520 0.000501
H 5.980307 0.335444 0.000981
H 3.011753 -3.775672 -0.001434
H -5.565648 -0.821244 -0.000634
H -1.533529 -3.820514 -0.000250
H 6.993546 -1.990561 0.000697
H 5.512553 -3.999895 -0.000532
H -5.864571 -3.333578 -0.000385
H -3.841704 -4.825301 -0.000208


