%chk=000117387.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117387

0 1
 O  -0.1881000     -0.4314000      -2.268200    
 O   -3.388200      -2.148600      0.5789000    
 O   -1.427400      -2.199400     -0.4165000    
 N   0.9131000     -0.4666000     -0.2264000    
 N    3.440600      0.7672000      0.2487000    
 N   -2.395400      -1.574200      7.5099997E-02
 C    2.117700      -1.155100     -0.6524000    
 C    1.206500      3.5300002E-02   1.109900    
 C    2.474500      -1.978400      0.5930000    
 C    1.869200      -1.183700       1.768500    
 C    3.174900     -6.5399997E-02 -0.9429000    
 C    2.205600       1.203000      0.9333000    
 C  -0.1373000     -0.1632000      -1.070100    
 C    4.301500       1.900100     -7.2300002E-02
 C   -1.287000      0.5413000     -0.4876000    
 C   -2.366100     -0.1516000      5.9799999E-02
 C   -1.281200       1.935700     -0.4909000    
 C   -3.440900      0.5509000      0.6047000    
 C   -2.356100       2.638100      5.3900000E-02
 C   -3.435900       1.945900      0.6017000    
 H    1.942800      -1.774400      -1.537500    
 H   0.3120000      0.3660000       1.643700    
 H    3.550900      -2.142100      0.7057000    
 H    1.993300      -2.962600      0.5437000    
 H    1.110200      -1.802300       2.262700    
 H    2.615700     -0.9119000       2.521500    
 H    4.106800     -0.5466000      -1.262600    
 H    2.821400      0.5629000      -1.771400    
 H    1.723700       2.007200      0.3631000    
 H    2.463400       1.604000       1.920700    
 H    3.829200       2.588700     -0.7819000    
 H    5.247100       1.554700     -0.5045000    
 H    4.555000       2.460000      0.8346000    
 H  -0.4477000       2.487300     -0.9178000    
 H   -4.301100      4.9699999E-02   1.041200    
 H   -2.352500       3.724200      5.0900001E-02
 H   -4.272600       2.493400       1.025600    


%chk=000117387-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000117387

0 1
O -0.429733 -0.819019 -2.166920
O -3.534618 -2.208138 0.882729
O -1.272322 -2.171456 0.615033
N 0.969961 -0.205307 -0.403709
N 3.584267 0.736889 0.299224
N -2.432004 -1.601531 0.600004
C 2.175221 -0.947736 -0.861485
C 1.276325 0.150835 1.006938
C 2.430530 -1.925452 0.327355
C 1.834763 -1.190800 1.577305
C 3.310933 0.092594 -1.009574
C 2.364894 1.252864 0.963886
C -0.246732 -0.275472 -1.030599
C 4.677698 1.719927 0.247629
C -1.404168 0.475401 -0.385318
C -2.494221 -0.156051 0.266657
C -1.510022 1.868925 -0.620420
C -3.655753 0.547007 0.655769
C -2.654613 2.593570 -0.222115
C -3.733283 1.931733 0.411939
H 1.962282 -1.445926 -1.819915
H 0.378621 0.515179 1.531076
H 3.507962 -2.125328 0.448291
H 1.906400 -2.879009 0.145946
H 1.015505 -1.778662 2.023218
H 2.604519 -1.000222 2.343232
H 4.236740 -0.408083 -1.350842
H 3.012595 0.832164 -1.795401
H 1.938678 2.149153 0.441296
H 2.631058 1.558840 1.993703
H 4.447399 2.610448 -0.390638
H 5.589154 1.241557 -0.154291
H 4.903606 2.081556 1.267288
H -0.692553 2.378112 -1.141509
H -4.467120 -0.000208 1.143090
H -2.709197 3.670202 -0.414901
H -4.625171 2.489543 0.713927


