%chk=000079176.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079176

0 1
 O   -1.896100      -2.038500     -0.1352000    
 N   -1.350700      0.2190000     -0.5207000    
 C   -1.771700       1.502800     -1.2300000E-02
 C   -3.146000       1.213300      0.5574000    
 C   -3.058200     -0.2413000       1.003600    
 C   -2.056300     -0.8405000      4.4799998E-02
 C  -0.2205000      9.1600001E-02  -1.415100    
 C    1.065500      5.1899999E-02 -0.6372000    
 C    1.731200       1.237200     -0.3528000    
 C    1.572100      -1.169400     -0.2120000    
 C    2.924300       1.200700      0.3691000    
 C    2.765100      -1.205900      0.5100000    
 C    3.441100     -2.0800000E-02  0.8005000    
 H   -1.805800       2.247600     -0.8123000    
 H   -1.072500       1.820000      0.7678000    
 H   -3.901900       1.306200     -0.2326000    
 H   -3.422700       1.893000       1.368000    
 H   -4.023200     -0.7484000      0.9310000    
 H   -2.664000     -0.3246000       2.021200    
 H  -0.2322000      0.9187000      -2.134100    
 H  -0.3317000     -0.8354000      -1.990800    
 H    1.337700       2.194100     -0.6842000    
 H    1.055400      -2.099100     -0.4324000    
 H    3.450600       2.123400      0.5954000    
 H    3.167800      -2.156900      0.8461000    
 H    4.370000     -4.9300000E-02   1.362600    


%chk=000079176-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000079176

0 1
O -2.092011 -2.004496 -0.852525
N -1.403078 0.230584 -0.540830
C -1.716251 1.397307 0.307398
C -3.159623 1.094077 0.807001
C -3.273467 -0.450756 0.733736
C -2.224351 -0.869395 -0.309385
C -0.223191 0.167518 -1.415056
C 1.097750 0.154346 -0.647175
C 2.037735 1.203171 -0.791676
C 1.398249 -0.923894 0.225718
C 3.259800 1.179640 -0.078883
C 2.615775 -0.949000 0.939589
C 3.551052 0.103629 0.789722
H -1.658592 2.333052 -0.279509
H -0.993991 1.477742 1.145149
H -3.893870 1.558798 0.125991
H -3.334092 1.492688 1.819814
H -4.270831 -0.812901 0.436664
H -3.018351 -0.936406 1.694682
H -0.245226 1.023677 -2.117279
H -0.338053 -0.765111 -1.999941
H 1.815920 2.040012 -1.466426
H 0.678217 -1.744363 0.332281
H 3.980185 1.996467 -0.201428
H 2.840315 -1.789480 1.606118
H 4.497280 0.082494 1.342051


