%chk=000139567.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139567

0 1
 O    2.048500     -0.2970000      0.5553000    
 N   -1.349400       1.956300     -0.2011000    
 C  -0.3299000     -0.1981000      0.1540000    
 C   0.9168000      0.4236000      0.3052000    
 C   -1.452100      0.6174000     -0.1017000    
 C  -0.4736000      -1.592600      0.2517000    
 C    1.025800       1.802900      0.2032000    
 C   -2.690400     -7.9999998E-04 -0.2519000    
 C    3.102800     -0.1952000     -0.3981000    
 C   -1.724100      -2.184300      9.7400002E-02
 C   -2.833500      -1.387100     -0.1548000    
 C  -0.1279000       2.517200     -4.8799999E-02
 C    3.886900      -1.462200     -0.4102000    
 H   0.3818000      -2.234800      0.4481000    
 H    1.972700       2.316700      0.3242000    
 H   -3.575200      0.6015000     -0.4501000    
 H    2.703700     -6.0000001E-03  -1.402800    
 H    3.751000      0.6429000     -0.1189000    
 H   -1.831300      -3.262000      0.1735000    
 H   -3.813000      -1.840400     -0.2767000    
 H  -0.1045000       3.598400     -0.1366000    
 H    4.712800      -1.410400      -1.125500    
 H    4.298600      -1.676700      0.5818000    
 H    3.249600      -2.312800     -0.6752000    


%chk=000139567-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000139567

0 1
O 1.932951 -0.659851 -0.175575
N -1.409717 1.986799 -0.103776
C -0.438490 -0.315998 -0.050631
C 0.883156 0.253957 -0.157363
C -1.557852 0.601965 -0.027983
C -0.673676 -1.723554 0.031302
C 1.025719 1.646410 -0.233894
C -2.882007 0.069467 0.076875
C 3.313843 -0.135103 -0.282748
C -1.979900 -2.212406 0.133021
C -3.089967 -1.310583 0.155940
C -0.152785 2.456946 -0.202326
C 4.244568 -1.344072 -0.284534
H 0.183895 -2.402554 0.012671
H 2.001665 2.130612 -0.316552
H -3.711137 0.783501 0.092078
H 3.406663 0.451584 -1.218869
H 3.515410 0.532713 0.578991
H -2.157216 -3.291724 0.195465
H -4.108414 -1.706831 0.235854
H -0.049097 3.547647 -0.261085
H 5.295905 -1.011197 -0.355986
H 4.125336 -1.928500 0.643465
H 4.027245 -2.002727 -1.142339


