%chk=000091349.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091349

0 1
 O    4.632400       3.192700      6.9999998E-04
 O    2.476400       3.605800      8.9999998E-04
 O   -4.778100      -3.024800      7.9999998E-04
 O   -2.657700      -3.592800      1.0000000E-03
 O    4.848100      -3.106600     -3.8999999E-03
 O    6.197200      -1.374700     -3.1999999E-03
 O   -4.647000       3.186000     -3.0000000E-03
 O   -6.122700       1.560700     -3.0000000E-03
 N   0.2943000     -0.7463000      1.6000000E-03
 N  -0.2400000      0.5557000      1.3000000E-03
 N   0.6518000       1.565000      1.1000000E-03
 N  -0.7476000      -1.760500      1.4000000E-03
 N    3.438400       2.794000      1.0000000E-03
 N   -3.561000      -2.723000      8.9999998E-04
 N    5.047000      -1.870000     -2.2000000E-03
 N   -4.935400       1.965300     -2.0000001E-03
 C    1.638600     -0.6165000      1.2000001E-03
 C   -1.609400      0.4532000      8.9999998E-04
 C    1.862300      0.8968000      1.0000000E-03
 C   -1.865500     -0.9523000      1.0000000E-03
 C    2.639500      -1.575100      8.9999998E-04
 C   -2.560100       1.445400      1.9999999E-04
 C    3.172700       1.407400      7.9999998E-04
 C   -3.193300      -1.349800      3.9999999E-04
 C    3.922700     -0.9943000      3.9999999E-04
 C   -3.883400       1.010100     -3.9999999E-04
 C    4.176800      0.4148000      3.9999999E-04
 C   -4.196800     -0.3662000     -1.9999999E-04
 H    2.434400      -2.636300      6.0000003E-04
 H   -2.273800       2.490300       0.000000    
 H    5.211800      0.7607000     -1.9999999E-04
 H   -5.242000     -0.6714000     -6.9999998E-04


%chk=000091349-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000091349

0 1
O 4.851296 3.091630 -0.000211
O 2.630737 3.639456 -0.000544
O -4.842912 -3.095276 0.000167
O -2.622225 -3.642885 -0.000122
O 4.806925 -3.204170 -0.000242
O 6.296437 -1.470351 -0.000009
O -4.798941 3.200616 0.000423
O -6.288356 1.466664 0.000359
N 0.267988 -0.661104 -0.000065
N -0.259981 0.657715 -0.000072
N 0.689638 1.649398 -0.000032
N -0.681372 -1.652602 -0.000191
N 3.596901 2.788372 0.000276
N -3.588552 -2.791900 -0.000270
N 5.100229 -1.948326 0.000338
N -5.092089 1.944659 -0.000202
C 1.646950 -0.523236 0.000044
C -1.638929 0.519757 -0.000131
C 1.874383 0.917627 0.000077
C -1.866211 -0.921181 -0.000171
C 2.660743 -1.487500 0.000111
C -2.652746 1.483967 -0.000131
C 3.238656 1.350603 0.000218
C -3.230402 -1.354204 -0.000209
C 3.971306 -0.981387 0.000243
C -3.963323 0.977906 -0.000179
C 4.270326 0.407178 0.000286
C -4.262142 -0.410847 -0.000196
H 2.469253 -2.563319 0.000076
H -2.461212 2.559798 -0.000104
H 5.311280 0.743621 0.000392
H -5.303055 -0.747379 -0.000224


