%chk=000142970.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000142970

0 1
 O  -0.3181000      0.4067000      -2.042800    
 O   0.3179000      0.4119000       2.040900    
 N   -2.121100      0.5187000     -0.5423000    
 N    2.122400      0.5177000      0.5418000    
 C   -2.897600     -0.1160000      0.5449000    
 C    2.898400     -0.1202000     -0.5438000    
 C   -3.616700      0.9010000       1.427200    
 C    3.620700      0.8940000      -1.426900    
 C   -4.461800       1.854000      0.5881000    
 C    4.467000       1.846300     -0.5885000    
 C  -0.4604000      -1.307800     -0.5235000    
 C   0.4578000      -1.305100      0.5242000    
 C  -0.9632000     -5.0299998E-02  -1.099200    
 C   0.9629000     -4.7899999E-02   1.098500    
 C   -2.613900       1.703700      -1.076900    
 C    2.617300       1.702400       1.075100    
 C   -3.700700       2.331700     -0.6085000    
 C    3.706000       2.327400      0.6068000    
 C  -0.9227000      -2.512800      -1.048300    
 C   0.9158000      -2.513400       1.049800    
 C  -0.4645000      -3.720900     -0.5228000    
 C   0.4548000      -3.721200      0.5262000    
 H   -2.251100     -0.7327000       1.174100    
 H   -3.621000     -0.7883000      6.6900000E-02
 H    2.250900     -0.7362000      -1.172700    
 H    3.619800     -0.7937000     -6.4300001E-02
 H   -2.870400       1.478800       1.988500    
 H   -4.245200      0.3886000       2.163800    
 H    2.876200       1.472600      -1.989700    
 H    4.248600      0.3791000      -2.162200    
 H   -4.757600       2.710500       1.204000    
 H   -5.380100       1.358700      0.2528000    
 H    4.765300       2.701200      -1.205300    
 H    5.384000       1.349400     -0.2516000    
 H   -2.082000       2.115600      -1.927900    
 H    2.085500       2.116600       1.925000    
 H   -4.046100       3.236200      -1.100300    
 H    4.052900       3.231900       1.097600    
 H   -1.639400      -2.524900      -1.865400    
 H    1.632300      -2.526400       1.867100    
 H  -0.8236000      -4.661400     -0.9303000    
 H   0.8115000      -4.661900      0.9353000    


%chk=000142970-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000142970

0 1
O -0.214074 -0.090861 -2.368657
O 0.214306 -0.088992 2.369118
N -1.759840 0.398986 -0.681322
N 1.760997 0.396395 0.681347
C -2.573448 -0.004670 0.501555
C 2.574038 -0.009924 -0.501004
C -2.854488 1.214971 1.402441
C 2.857073 1.208240 -1.403252
C -3.594155 2.325592 0.619415
C 3.598526 2.318524 -0.621438
C -0.414004 -1.701902 -0.579051
C 0.411292 -1.702122 0.581060
C -0.788464 -0.411165 -1.274597
C 0.788117 -0.411397 1.275368
C -2.105162 1.629785 -1.304874
C 2.108380 1.627271 1.303603
C -2.973555 2.520149 -0.750504
C 2.978277 2.515578 0.748288
C -0.798497 -2.933401 -1.162867
C 0.793379 -2.933773 1.166129
C -0.401068 -4.157291 -0.583032
C 0.393555 -4.157474 0.587542
H -2.034717 -0.775946 1.069672
H -3.527684 -0.436158 0.136188
H 2.034126 -0.781014 -1.068247
H 3.527560 -0.442507 -0.135067
H -1.890845 1.589969 1.791101
H -3.449660 0.883373 2.272552
H 1.894040 1.584340 -1.792362
H 3.451741 0.874714 -2.272967
H -3.557625 3.276543 1.185914
H -4.671646 2.076295 0.516673
H 3.563502 3.268916 -1.188971
H 4.675625 2.067627 -0.518458
H -1.614268 1.789379 -2.267999
H 1.617709 1.788704 2.266533
H -3.208331 3.429268 -1.315253
H 3.214607 3.424899 1.312062
H -1.408073 -2.924401 -2.072702
H 1.402942 -2.925036 2.075976
H -0.709543 -5.103782 -1.039784
H 0.700155 -5.104102 1.045271


