%chk=000076519.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076519

0 1
 O    3.119300      -1.150100     -9.9999997E-05
 N    1.926300      0.8943000      9.9999997E-05
 C   -2.102000     -0.2397000       0.000000    
 C   0.5834000      0.5161000       0.000000    
 C   -1.758000       1.112000       0.000000    
 C   -1.103400      -1.213600       0.000000    
 C  -0.4153000       1.489900     -9.9999997E-05
 C   0.2393000     -0.8356000      9.9999997E-05
 C   -3.537700     -0.6440000       0.000000    
 C    3.048100      7.0900001E-02   0.000000    
 H   -2.527000       1.880100     -1.9000000E-03
 H   -1.360000      -2.269800     -1.8000000E-03
 H  -0.1616000       2.547000     -6.0000003E-04
 H   0.9595000      -1.642600     -1.9999999E-04
 H   -3.680200      -1.595200      0.5241000    
 H   -4.157900      9.9500000E-02  0.5121000    
 H   -3.897300     -0.7525000      -1.028000    
 H    2.104600       1.896100      9.9999997E-05
 H    3.960400      0.6918000      9.9999997E-05


%chk=000076519-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076519

0 1
O 3.197635 -1.127708 -0.010483
N 1.976894 0.901072 -0.005415
C -2.151296 -0.252744 0.016212
C 0.615683 0.471908 0.000689
C -1.753242 1.109483 0.014140
C -1.128939 -1.236082 0.016274
C -0.392370 1.472092 0.005123
C 0.240519 -0.897692 0.007049
C -3.619140 -0.641793 -0.007809
C 3.135093 0.131487 -0.009577
H -2.516704 1.897081 0.021136
H -1.407128 -2.297442 0.024881
H -0.111826 2.534177 0.006051
H 1.015024 -1.667149 0.008938
H -3.789503 -1.605837 0.503700
H -4.248586 0.122120 0.482720
H -3.986379 -0.752861 -1.047152
H 2.121732 1.914921 -0.007152
H 4.043033 0.779567 -0.015426


