%chk=000173633.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173633

0 1
 O  -0.2397000      6.4499997E-02   1.721800    
 O  -0.8437000       3.198100     -0.6001000    
 N   0.8246000       1.514500      0.3050000    
 N   -1.512100       1.012700     -9.9999998E-03
 N    4.542200     -0.4153000      -1.301400    
 N   -1.732700       2.350500     -0.7217000    
 C    2.115600       1.394700      0.9428000    
 C    2.936700      0.2883000      0.3461000    
 C   -2.465400     -2.7000001E-03 -9.3500003E-02
 C  -0.2998000      0.8224000      0.7485000    
 C    2.860500     -0.9959000      0.8546000    
 C   -2.069200      -1.338400     -2.5599999E-02
 C   -3.814500      0.3178000     -0.2452000    
 C    3.777700      0.5349000     -0.7178000    
 C   -3.022200      -2.353600     -0.1094000    
 C   -4.767400     -0.6974000     -0.3286000    
 C    3.631800      -2.000400      0.2808000    
 C   -4.371400      -2.033100     -0.2607000    
 C    4.449000      -1.661500     -0.7856000    
 H    1.983900       1.235300       2.019600    
 H    2.628000       2.356500      0.8261000    
 H   0.7692000       2.062400     -0.5468000    
 H    2.214200      -1.233000       1.694100    
 H   -1.025600      -1.629000      5.7000000E-02
 H   -4.156600       1.348300     -0.2882000    
 H    3.871800       1.524100      -1.153900    
 H   -2.713500      -3.393900     -6.4599998E-02
 H   -5.818300     -0.4482000     -0.4439000    
 H    3.595100      -3.016300      0.6569000    
 H   -5.113100      -2.823500     -0.3270000    
 H    5.070600      -2.408500      -1.268100    


%chk=000173633-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000173633

0 1
O -0.210473 -0.445118 1.346355
O -0.677761 2.481081 -1.598995
N 0.797658 1.351972 0.241183
N -1.417944 0.667947 -0.382872
N 5.176307 0.100999 -0.839540
N -1.628922 1.637441 -1.396468
C 2.044343 1.291784 1.036564
C 3.096728 0.359667 0.445705
C -2.584909 -0.173903 -0.186861
C -0.220543 0.468951 0.477795
C 3.008576 -1.047934 0.601503
C -2.455009 -1.579113 -0.087267
C -3.859853 0.439701 -0.146493
C 4.201747 0.875011 -0.276831
C -3.614674 -2.368192 0.063015
C -5.012364 -0.361927 -0.006137
C 4.006541 -1.864588 0.027607
C -4.894142 -1.766486 0.101700
C 5.065183 -1.251334 -0.683513
H 1.776428 0.961538 2.055506
H 2.441699 2.320214 1.098509
H 0.660121 2.050758 -0.509380
H 2.170850 -1.480654 1.159444
H -1.467507 -2.044009 -0.117915
H -3.940611 1.527976 -0.220898
H 4.320090 1.958248 -0.413465
H -3.517216 -3.455897 0.144465
H -5.999037 0.112018 0.025636
H 3.972297 -2.953887 0.129409
H -5.789631 -2.386255 0.218077
H 5.857728 -1.851710 -1.144636


