%chk=000075238.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075238

0 1
 O   0.1445000      0.5210000      0.7315000    
 N   -5.591000      0.4812000     -0.4362000    
 C   -2.186700      0.2397000      0.2600000    
 C  -0.8395000     -0.4528000      0.4108000    
 C   -3.291600     -0.7487000     -0.1011000    
 C    1.426300      0.2637000      0.3198000    
 C    1.863100      -1.051600      0.2116000    
 C    2.275900       1.320900      1.5300000E-02
 C    3.167700      -1.313300     -0.2066000    
 C    3.580700       1.059000     -0.4030000    
 C    4.026500     -0.2581000     -0.5140000    
 C   -4.575900     -6.1000001E-02 -0.2880000    
 H   -2.433000      0.7672000       1.190900    
 H   -2.107900       1.022500     -0.5062000    
 H  -0.6154000     -0.9580000     -0.5379000    
 H  -0.8870000      -1.194500       1.216600    
 H   -3.029100      -1.281600      -1.022400    
 H   -3.390100      -1.501600      0.6893000    
 H    1.236400      -1.900000      0.4685000    
 H    1.932600       2.347900      0.1004000    
 H    3.517600      -2.338500     -0.2868000    
 H    4.249500       1.880600     -0.6419000    
 H    5.042800     -0.4618000     -0.8383000    


%chk=000075238-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000075238

0 1
O 0.094279 0.641050 -0.001764
N -5.830331 0.394294 0.201856
C -2.275103 0.276194 0.081506
C -0.913975 -0.424898 0.024621
C -3.430096 -0.762423 0.114530
C 1.450338 0.263850 -0.050781
C 1.907080 -1.077002 -0.080219
C 2.374456 1.337743 -0.069741
C 3.298513 -1.330920 -0.128625
C 3.755899 1.067246 -0.117960
C 4.227933 -0.268766 -0.147707
C -4.758287 -0.127912 0.162877
H -2.317765 0.918156 0.978718
H -2.383298 0.934309 -0.798314
H -0.827017 -1.053259 -0.887632
H -0.759930 -1.071329 0.915146
H -3.386917 -1.413524 -0.780735
H -3.327145 -1.423731 0.997313
H 1.206467 -1.917294 -0.066134
H 1.990867 2.362387 -0.046101
H 3.651285 -2.368262 -0.151250
H 4.466562 1.901046 -0.132222
H 5.302587 -0.474754 -0.185081


