%chk=000168675.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168675

0 1
 O  -0.3497000       2.421100     -1.1000000E-03
 O   -4.609000       1.351000      4.4999998E-03
 O    4.761700       1.043700     -1.9999999E-04
 N   -2.308900       1.137600     -5.0000002E-04
 N    2.431800       1.159300      1.9999999E-04
 C   -1.208000      0.3184000     -2.0000001E-03
 C  -5.5500001E-02   1.073900     -1.8000000E-03
 C    1.186500      0.4496000     -1.1000000E-03
 C   -1.270000      -1.053200     -2.2000000E-03
 C    1.190500     -0.9729000     -1.2000001E-03
 C   -1.803700       2.499400     -3.9999999E-04
 C  -3.7900001E-02  -1.702600     -2.0000001E-03
 C   -2.617300      -1.652300     -1.1000000E-03
 C    2.484700      -1.687400      1.1000000E-03
 C   -3.594000      0.6606000      2.0000001E-03
 C   -3.697200     -0.8413000      1.4000000E-03
 C    3.658300      0.4959000      3.0000001E-04
 C    3.623500     -0.9842000      1.9000000E-03
 C   -2.748400      -3.145100     -1.8000000E-03
 C    2.437200       2.618300      6.0000003E-04
 C    2.525500      -3.189700      3.4000000E-03
 H   -2.148400       3.023800      0.8967000    
 H   -2.149300       3.024200     -0.8971000    
 H  -2.4300000E-02  -2.789600     -1.8000000E-03
 H   -4.704700      -1.246000      2.7999999E-03
 H    4.588900      -1.482100      3.7000000E-03
 H   -2.279000      -3.575400     -0.8928000    
 H   -3.797200      -3.461900     -8.9999998E-04
 H   -2.277300      -3.576400      0.8879000    
 H    1.940800       2.986000      0.9035000    
 H    3.456700       3.015100      1.5000000E-03
 H    1.942300       2.986500     -0.9030000    
 H    2.033600      -3.591800      0.8956000    
 H    2.036400      -3.594500     -0.8890000    
 H    3.552700      -3.571900      5.5999998E-03


%chk=000168675-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168675

0 1
O -0.384480 2.466736 0.000088
O -4.643070 1.446672 -0.000546
O 4.789555 1.152010 0.001238
N -2.323618 1.141663 -0.000572
N 2.436863 1.150618 0.000877
C -1.211994 0.312375 -0.000188
C -0.041330 1.077528 0.000145
C 1.224098 0.450153 0.000558
C -1.273901 -1.096236 0.000025
C 1.205998 -1.014550 0.000663
C -1.881015 2.557010 -0.000538
C -0.012648 -1.744477 0.000420
C -2.616912 -1.674572 -0.000085
C 2.493952 -1.709774 0.001001
C -3.649779 0.651538 -0.000450
C -3.714623 -0.822617 -0.000301
C 3.704904 0.484897 0.001342
C 3.659412 -0.974501 0.001263
C -2.784029 -3.178083 0.000137
C 2.461513 2.635038 0.000697
C 2.548614 -3.224513 0.001034
H -2.209689 3.090770 0.907987
H -2.208891 3.090557 -0.909479
H 0.030740 -2.836502 0.000581
H -4.732228 -1.224854 -0.000326
H 4.639592 -1.459256 0.001471
H -2.305406 -3.630454 -0.889290
H -3.847610 -3.465308 -0.000172
H -2.306022 -3.630109 0.890073
H 1.956461 3.030914 0.896034
H 3.520578 2.932441 0.001183
H 1.957388 3.030694 -0.895268
H 2.047461 -3.647757 0.891981
H 2.048096 -3.647734 -0.890283
H 3.593322 -3.574216 0.001398


