%chk=000141018.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000141018

0 1
 O    2.640700      0.1153000     -0.2164000    
 O    1.862000      -1.830300      0.7134000    
 O   -3.821800      -1.066600     -0.3177000    
 O   -4.006600       1.115800     -0.1690000    
 N   -1.300100       1.401100      0.1221000    
 N   -3.292600      7.2700001E-02 -0.1774000    
 C   0.3196000     -0.1175000      0.1688000    
 C  -0.9191000     -0.7830000     -4.6000001E-03
 C   5.4400001E-02   1.231900      0.2446000    
 C   -1.903500      0.1802000     -2.9800000E-02
 C   -1.117600      -2.242000     -0.1349000    
 C   0.9508000       2.391800      0.4215000    
 C    1.630000     -0.6978000      0.2563000    
 C    3.974700     -0.4022000     -0.1584000    
 C    4.929100      0.6307000     -0.7184000    
 H   -1.780100       2.291000      0.1407000    
 H   -1.592500      -2.646000      0.7651000    
 H   -1.750200      -2.476400     -0.9974000    
 H  -0.1810000      -2.783500     -0.2898000    
 H    1.510900       2.590000     -0.4979000    
 H   0.3908000       3.299400      0.6714000    
 H    1.663600       2.216100       1.233600    
 H    4.234000     -0.6214000      0.8831000    
 H    4.033700      -1.322100     -0.7502000    
 H    5.960200      0.2679000     -0.6882000    
 H    4.669400      0.8735000      -1.754100    
 H    4.865100       1.563300     -0.1481000    


%chk=000141018-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000141018

0 1
O 2.676897 0.148384 -0.126054
O 1.858761 -2.033055 -0.136412
O -3.937072 -1.056730 0.112913
O -3.982061 1.245373 0.198558
N -1.310454 1.407285 0.099277
N -3.350066 0.098510 0.131541
C 0.312569 -0.151393 -0.023597
C -0.951091 -0.856308 0.000205
C 0.054687 1.255437 0.039215
C -1.930736 0.155049 0.077007
C -1.199889 -2.337022 -0.046864
C 0.965373 2.446120 0.049072
C 1.634596 -0.795249 -0.098537
C 4.056869 -0.424079 -0.199653
C 5.021119 0.753632 -0.298784
H -1.848447 2.275069 0.153884
H -1.748113 -2.668163 0.854110
H -1.851410 -2.594898 -0.901400
H -0.250996 -2.885471 -0.122348
H 1.589784 2.469803 -0.860138
H 0.389694 3.386072 0.113960
H 1.667038 2.395851 0.898915
H 4.226386 -1.035241 0.705227
H 4.110636 -1.091905 -1.078045
H 6.059945 0.380072 -0.351675
H 4.823312 1.352143 -1.204716
H 4.936569 1.412615 0.582640


