%chk=000039427.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039427

0 1
 O    1.107900      0.3537000      -2.341500    
 O    2.091000       1.688800       1.985000    
 O   -3.543300       1.368400      0.8781000    
 N    1.335500       1.372500     -0.2277000    
 N   -3.648200     -0.2489000     -0.7844000    
 C   0.4653000       2.505400     -0.3810000    
 C  -0.9485000       2.226800      0.1252000    
 C   -1.658700       1.094400     -0.6186000    
 C    2.510100     -0.5322000     -0.6478000    
 C    2.803700     -0.1316000      0.6474000    
 C    1.564000      0.4275000      -1.215500    
 C    2.049500       1.090200      0.9262000    
 C   -3.045200      0.7827000     -7.9300001E-02
 C    3.070100      -1.662200      -1.207200    
 C    3.672800     -0.8399000       1.451300    
 C   -4.960700     -0.7556000     -0.4570000    
 C   -4.852000      -1.894800      0.5533000    
 C    3.954600      -2.395600     -0.4111000    
 C    4.252800      -1.988500      0.9054000    
 C   -6.220600      -2.461000      0.8989000    
 H   0.4297000       2.787300      -1.439300    
 H   0.8863000       3.345100      0.1834000    
 H   -1.543600       3.144300      3.7400000E-02
 H  -0.9100000       1.984900       1.195200    
 H   -1.750900       1.348600      -1.681100    
 H   -1.080600      0.1671000     -0.5407000    
 H    2.840500      -1.975800      -2.218700    
 H    3.902100     -0.5276000       2.463300    
 H   -5.574600      5.8699999E-02 -5.7000000E-02
 H   -5.416100      -1.106500      -1.388800    
 H   -3.150600     -0.6820000      -1.557000    
 H   -4.219400      -2.693900      0.1483000    
 H   -4.364600      -1.540400       1.469500    
 H    4.419900      -3.293200     -0.8103000    
 H    4.944000      -2.578000       1.502400    
 H   -6.863100      -1.691900       1.339300    
 H   -6.717900      -2.856000      7.3000002E-03
 H   -6.121600      -3.276400       1.622300    


%chk=000039427-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000039427

0 1
O 1.387107 0.758172 -2.416940
O 1.900877 1.368675 2.226479
O -3.904425 1.563403 -0.194853
N 1.384480 1.300485 -0.096717
N -3.583941 -0.700174 -0.625668
C 0.358529 2.360603 -0.115905
C -1.047440 1.868401 0.287518
C -1.613559 0.787689 -0.658905
C 2.878261 -0.361080 -0.762883
C 3.030714 -0.181458 0.633664
C 1.823340 0.586883 -1.250501
C 2.079941 0.889809 1.079295
C -3.123854 0.596409 -0.458248
C 3.646496 -1.298287 -1.469144
C 3.957112 -0.933268 1.371199
C -5.009801 -1.053251 -0.513723
C -5.392264 -1.621274 0.873682
C 4.586142 -2.065714 -0.731810
C 4.738820 -1.886094 0.666462
C -6.891393 -1.980897 0.948568
H 0.343531 2.768569 -1.142928
H 0.690217 3.152096 0.579410
H -1.737091 2.732851 0.271090
H -1.026800 1.497250 1.328920
H -1.450812 1.102915 -1.709125
H -1.074963 -0.171751 -0.532902
H 3.522354 -1.425351 -2.549106
H 4.068582 -0.783620 2.449646
H -5.581779 -0.127765 -0.703799
H -5.262959 -1.784642 -1.306206
H -2.905012 -1.443158 -0.798465
H -4.778560 -2.518762 1.090954
H -5.143022 -0.866063 1.642356
H 5.205007 -2.807059 -1.248509
H 5.473031 -2.491771 1.208376
H -7.521675 -1.090779 0.765613
H -7.159858 -2.745661 0.194903
H -7.155735 -2.381929 1.943403


