%chk=000018490.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018490

0 1
 O   -3.454800     -0.4655000       1.104400    
 O   -1.217200      0.8579000       1.599700    
 N  -0.3947000      0.6279000     -0.5513000    
 N   0.7415000       1.319800     -0.2477000    
 C   -2.572300     -0.3457000     -9.1000004E-03
 C   -2.207400      -1.759400     -0.5152000    
 C   -3.333000      0.4163000      -1.117500    
 C   -1.332200      0.4418000      0.4465000    
 C   -1.519900      -2.647100      0.5180000    
 C   -3.839900       1.791200     -0.6896000    
 C    1.963100      0.6412000     -0.1693000    
 C    3.092800       1.275900      0.3615000    
 C    2.069600     -0.6804000     -0.6198000    
 C    4.310200      0.5996000      0.4405000    
 C    3.286900      -1.356800     -0.5407000    
 C    4.407200     -0.7167000     -1.0600000E-02
 H   -3.124900      -2.276800     -0.8244000    
 H   -1.566000      -1.695700      -1.402200    
 H   -4.211200     -0.1709000      -1.416500    
 H   -2.709600      0.5314000      -2.011700    
 H   -2.172500      -2.849000       1.372500    
 H   -1.262400      -3.610900      6.6500001E-02
 H  -0.5948000      -2.194400      0.8863000    
 H   -4.390900       2.257700      -1.512800    
 H   -3.013800       2.457200     -0.4231000    
 H   -4.517600       1.720200      0.1666000    
 H   -2.973500     -0.8886000       1.834900    
 H  -0.4990000      0.3341000      -1.516100    
 H   0.6476000       2.266500      9.6500002E-02
 H    3.031600       2.301600      0.7171000    
 H    1.224000      -1.214500      -1.044700    
 H    5.182500       1.097800      0.8532000    
 H    3.363400      -2.381400     -0.8929000    
 H    5.355100      -1.243200      5.0700001E-02


%chk=000018490-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018490

0 1
O -3.459112 -0.559140 1.134325
O -1.129735 0.621954 1.602397
N -0.428119 0.650576 -0.612303
N 0.758869 1.352071 -0.339128
C -2.621698 -0.421271 -0.058256
C -2.268201 -1.842518 -0.593319
C -3.427915 0.388702 -1.114100
C -1.330455 0.322617 0.383761
C -1.517828 -2.721869 0.426032
C -3.781730 1.820488 -0.667817
C 1.977133 0.629589 -0.176675
C 3.100711 1.317907 0.355296
C 2.113023 -0.720132 -0.590787
C 4.339855 0.657837 0.473872
C 3.362374 -1.367303 -0.469447
C 4.482973 -0.688704 0.060528
H -3.227764 -2.324610 -0.861007
H -1.682733 -1.748649 -1.531369
H -4.359552 -0.181272 -1.291602
H -2.879679 0.401075 -2.079554
H -2.112317 -2.818206 1.350516
H -1.350238 -3.734521 0.017369
H -0.532560 -2.297764 0.694768
H -4.422662 2.316789 -1.418219
H -2.880311 2.446778 -0.529103
H -4.329236 1.789484 0.289477
H -2.923123 -0.208520 1.904098
H -0.664884 0.529278 -1.598852
H 0.611808 2.140292 0.299660
H 3.000711 2.363134 0.673154
H 1.249330 -1.261216 -0.990324
H 5.197278 1.197701 0.891232
H 3.455923 -2.411759 -0.788241
H 5.447763 -1.197716 0.153318


