%chk=000011099.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011099

0 1
 O   -1.795900      -1.862200     -7.4199997E-02
 O    3.997900      0.3335000      0.2992000    
 N   -3.835500      0.1198000      0.1713000    
 C   -1.532200     -0.5047000     -0.4395000    
 C   -2.421300      0.4485000      0.3904000    
 C  -4.8500001E-02 -0.2794000     -0.2413000    
 C   -2.215000       1.917900      1.7600000E-02
 C   0.7454000     -4.9999999E-03  -1.340700    
 C   0.4805000     -0.3539000       1.035200    
 C    2.112800      0.2018000      -1.157700    
 C    1.847700     -0.1471000       1.218100    
 C    2.664000      0.1307000      0.1216000    
 H   -1.785600     -0.4135000      -1.503300    
 H   -2.233300      0.3251000       1.462800    
 H   -1.199000       2.248900      0.2553000    
 H   -2.385200       2.089300      -1.051400    
 H   -2.902800       2.563400      0.5758000    
 H   0.3278000      5.3399999E-02  -2.341500    
 H  -0.1373000     -0.5793000       1.899000    
 H   -3.994700     -0.8638000      0.3861000    
 H   -4.065700      0.2319000     -0.8157000    
 H   -2.085000      -1.883800      0.8537000    
 H    2.737700      0.4177000      -2.020200    
 H    2.271700     -0.2057000       2.216800    
 H    4.407300      0.5131000     -0.5647000    


%chk=000011099-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000011099

0 1
O -2.031228 -1.799037 0.289397
O 4.058680 0.326240 0.415738
N -3.906882 0.230353 0.352150
C -1.591919 -0.524340 -0.334102
C -2.471054 0.563143 0.372346
C -0.097575 -0.317063 -0.168654
C -2.250960 1.954147 -0.247592
C 0.713704 0.070633 -1.262515
C 0.518036 -0.487448 1.102839
C 2.098706 0.296084 -1.102423
C 1.897029 -0.269383 1.278594
C 2.687734 0.126022 0.173388
H -1.850945 -0.530538 -1.417541
H -2.145964 0.583397 1.431876
H -1.190650 2.254895 -0.202030
H -2.565871 1.967580 -1.310627
H -2.856916 2.698783 0.295812
H 0.261332 0.200909 -2.253379
H -0.094377 -0.805291 1.953835
H -4.078157 -0.732450 0.666550
H -4.346054 0.408487 -0.559846
H -1.417615 -2.520081 -0.000506
H 2.712097 0.595214 -1.962577
H 2.378679 -0.398887 2.252431
H 4.525972 0.605231 -0.410465


