%chk=000113319.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000113319

1 1
 O   -4.473800      -1.441700      0.9960000    
 N  -0.2954000      0.5558000     -0.3955000    
 C   -1.564600     -7.1000000E-03 -0.8856000    
 C   0.7739000     -0.2435000     -0.2203000    
 C  -0.2726000       1.871100     -0.1429000    
 C   -2.408700     -0.4521000      0.2998000    
 C    1.980200      0.3203000      0.2510000    
 C   0.8835000       2.476400      0.3211000    
 C    2.017000       1.695400      0.5192000    
 C   0.6933000      -1.611200     -0.5002000    
 C   -3.740500      -1.032900     -0.1501000    
 C   -1.499900       2.692400     -0.3615000    
 C    3.093200     -0.5159000      0.4324000    
 C    1.809100      -2.426300     -0.3140000    
 C    3.005300      -1.880800      0.1507000    
 H   -2.100400      0.7247000      -1.496000    
 H   -1.384800     -0.8072000      -1.607200    
 H   -1.873900      -1.210400      0.8855000    
 H   -2.587900      0.3625000       1.009400    
 H   0.9223000       3.540900      0.5306000    
 H    2.927700       2.165300      0.8831000    
 H  -0.2034000      -2.119000     -0.8329000    
 H   -3.589200      -1.904100     -0.7954000    
 H   -4.329100     -0.2853000     -0.6912000    
 H   -2.379300       2.301500      0.1522000    
 H   -1.358500       3.706000      3.3399999E-02
 H   -1.703300       2.808400      -1.430900    
 H    4.035900     -0.1118000      0.7944000    
 H    1.745700      -3.490200     -0.5241000    
 H    3.871600      -2.520000      0.2960000    
 H   -5.317400      -1.807100      0.6794000    


%chk=000113319-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000113319

1 1
O -4.456519 -1.616967 1.005999
N -0.338905 0.620512 -0.417882
C -1.639855 0.031977 -0.891836
C 0.763640 -0.246185 -0.216808
C -0.260464 1.970506 -0.155403
C -2.474418 -0.537747 0.275029
C 2.015525 0.315887 0.237693
C 0.967178 2.522364 0.302300
C 2.089467 1.717405 0.489986
C 0.676649 -1.649834 -0.448713
C -3.803133 -1.138613 -0.210997
C -1.458000 2.863983 -0.361134
C 3.145826 -0.541545 0.431313
C 1.802105 -2.459554 -0.248383
C 3.045155 -1.911167 0.189802
H -2.197934 0.819932 -1.418983
H -1.409827 -0.741155 -1.642633
H -1.916659 -1.323443 0.815647
H -2.705337 0.253730 1.011761
H 1.005689 3.595210 0.500297
H 3.031854 2.153644 0.837124
H -0.252452 -2.121879 -0.771199
H -3.617231 -1.969481 -0.927091
H -4.415307 -0.365756 -0.726002
H -2.360882 2.489443 0.151280
H -1.240767 3.867021 0.034820
H -1.702999 2.981404 -1.434114
H 4.088027 -0.100454 0.773005
H 1.722202 -3.536031 -0.428952
H 3.907740 -2.567002 0.336675
H -5.334370 -2.022105 0.793800


