%chk=000152974.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152974

0 1
 O   -3.463900     -0.2584000      0.1860000    
 N   3.8199998E-02 -1.4200000E-02 -0.3089000    
 N   -1.568700       1.328400      0.5830000    
 N   -2.229800     -0.7491000     -0.2519000    
 C    2.874300     -0.1363000      0.1573000    
 C    1.947400      -1.285100      0.5508000    
 C    2.119600       1.191800      0.1527000    
 C   0.7006000      -1.319400     -0.3310000    
 C   0.8697000       1.117600     -0.7220000    
 C   -1.287300      0.1246000     -1.5900001E-02
 H    3.717900     -8.2900003E-02  0.8544000    
 H    3.290300     -0.3258000     -0.8397000    
 H    2.482800      -2.237800      0.4754000    
 H    1.649200      -1.163400       1.599700    
 H    1.832000       1.448100       1.180000    
 H    2.778300       1.989800     -0.2077000    
 H   0.9702000      -1.572100      -1.363400    
 H   3.2699998E-02  -2.109700      3.0700000E-02
 H   0.3492000       2.080700     -0.7096000    
 H    1.168000      0.9622000      -1.767000    
 H   -2.522300       1.565700      0.8353000    
 H  -0.8439000       1.927600      0.9616000    
 H   -4.058700     -0.9915000     -4.5800000E-02


%chk=000152974-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152974

0 1
O -3.506126 -0.410249 -0.084154
N 0.075170 0.119543 0.114505
N -1.861660 1.488852 0.438281
N -2.065318 -0.783756 -0.322692
C 2.974876 -0.236065 -0.035052
C 2.046511 -1.317968 0.563649
C 2.336899 1.163545 0.123799
C 0.632840 -1.245170 -0.049882
C 0.921457 1.185278 -0.488828
C -1.324205 0.261003 0.066440
H 3.969679 -0.265964 0.448163
H 3.132734 -0.443851 -1.114028
H 2.463661 -2.328223 0.388060
H 1.969668 -1.174807 1.659202
H 2.270532 1.421331 1.198973
H 2.958615 1.934977 -0.370165
H 0.673109 -1.520655 -1.129173
H -0.055628 -1.955860 0.435396
H 0.437979 2.164139 -0.335654
H 0.997435 1.026711 -1.591347
H -2.879075 1.545521 0.401115
H -1.354661 2.087850 1.084484
H -3.968693 -1.225380 -0.397091


