%chk=000127008.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127008

0 1
 O    1.706800      0.4658000     -0.2224000    
 N   -2.370900      -1.893700      0.2096000    
 N    3.262400      -1.174700     -0.1610000    
 C  -0.3960000     -0.8996000      1.3800000E-02
 C   -1.404600      0.1036000     -2.2200000E-02
 C   -2.634200     -0.5466000      0.1026000    
 C    1.060400     -0.7253000     -8.1900001E-02
 C   -1.021300      -2.116800      0.1571000    
 C   -1.389300       1.506900     -0.1494000    
 C   -3.854200      0.1389000      0.1064000    
 C    3.020800      0.1128000     -0.2622000    
 C    3.980600       1.217300     -0.4104000    
 C    2.008600      -1.717800     -4.5200001E-02
 C   -2.602000       2.205800     -0.1470000    
 C   -3.814200       1.530300     -2.1000000E-02
 C    4.447000       1.793100      0.9332000    
 H  -0.6388000      -3.126000      0.2270000    
 H   -3.073200      -2.613200      0.3121000    
 H  -0.4568000       2.054400     -0.2489000    
 H   -4.798500     -0.3860000      0.2045000    
 H    4.856700      0.8618000     -0.9651000    
 H    3.536300       2.021600      -1.008300    
 H    1.873200      -2.784900      5.7000000E-02
 H   -2.596500       3.288200     -0.2447000    
 H   -4.744200       2.093100     -2.1700000E-02
 H    3.600100       2.189500       1.503400    
 H    5.162500       2.604700      0.7693000    
 H    4.932600       1.022500       1.541300    


%chk=000127008-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127008

0 1
O 1.700924 0.280328 -0.204191
N -2.463149 -1.918027 0.193273
N 3.364262 -1.286808 -0.302779
C -0.355206 -1.062655 -0.012176
C -1.304664 0.046001 0.006866
C -2.618900 -0.525510 0.136482
C 1.086041 -1.002422 -0.128226
C -1.108479 -2.240273 0.104889
C -1.176871 1.458232 -0.073780
C -3.790567 0.260637 0.187393
C 3.098575 0.013947 -0.310015
C 4.021874 1.185583 -0.394441
C 2.114073 -1.937300 -0.191517
C -2.341707 2.248208 -0.023731
C -3.634172 1.658543 0.105419
C 3.992452 2.078454 0.874137
H -0.772348 -3.274941 0.132567
H -3.220076 -2.591819 0.285276
H -0.189065 1.915066 -0.173475
H -4.783685 -0.191548 0.286455
H 5.035650 0.782331 -0.557877
H 3.762169 1.798442 -1.279479
H 2.051668 -3.021724 -0.167646
H -2.257680 3.338892 -0.084940
H -4.519527 2.302974 0.141374
H 2.979469 2.479958 1.050754
H 4.687998 2.928690 0.758893
H 4.294240 1.502441 1.766393


