%chk=000078756.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078756

0 1
 O   -1.133700      -1.721200     -4.3000001E-03
 O    1.135100      -1.735000     -4.3000001E-03
 O   1.2100000E-02  0.3105000      2.6000000E-03
 O   -6.453200       1.424500      -1.094500    
 O    6.442800       1.425200       1.101100    
 O   -6.456400       1.414500       1.100600    
 O    6.444000       1.429000      -1.094100    
 N   -5.931400       1.110200      2.4000001E-03
 N    5.921300       1.115600      2.7000001E-03
 C   -2.305700      -1.029100     -2.6000000E-03
 C    2.335200      -1.019700     -2.6000000E-03
 C   -4.709300      0.3872000      7.9999998E-04
 C    4.702000      0.3877000      7.9999998E-04
 C   -2.905800     -0.6706000      -1.209700    
 C    2.904000     -0.6849000       1.206200    
 C   -2.907500     -0.6794000       1.206100    
 C    2.903500     -0.6785000      -1.209800    
 C   -4.107500      3.7500001E-02  -1.208000    
 C    4.102800      2.8100001E-02   1.207900    
 C   -4.109200      2.8700000E-02   1.207900    
 C    4.102400      3.4400001E-02  -1.208000    
 C   1.4500000E-02 -0.9147000     -1.3000000E-03
 H   -2.442300     -0.9407000      -2.154700    
 H    2.437600     -0.9658000       2.145300    
 H   -2.445300     -0.9563000       2.149900    
 H    2.436800     -0.9544000      -2.150100    
 H   -4.545800      0.3001000      -2.167500    
 H    4.541000      0.2863000       2.168700    
 H   -4.549000      0.2842000       2.168500    
 H    4.540300      0.2977000      -2.167500    


%chk=000078756-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000078756

0 1
O -1.109108 -1.412715 -0.003357
O 1.107629 -1.412351 -0.003366
O -0.001042 0.674426 0.001503
O -6.901897 1.032880 -1.138144
O 6.900673 1.027271 1.142940
O -6.904548 1.020730 1.143279
O 6.901644 1.030184 -1.138500
N -6.344739 0.799967 0.002007
N 6.342871 0.801610 0.001691
C -2.404248 -0.798916 -0.001851
C 2.402784 -0.798195 -0.001987
C -4.967916 0.239994 0.000638
C 4.966018 0.241281 0.000396
C -3.032740 -0.540956 -1.236187
C 3.031958 -0.548080 1.233537
C -3.035513 -0.553705 1.233659
C 3.032939 -0.544871 -1.236352
C -4.336953 -0.010656 -1.237579
C 4.336076 -0.017501 1.237432
C -4.339766 -0.023501 1.237612
C 4.337062 -0.014277 -1.237811
C -0.000797 -0.564227 -0.001253
H -2.509075 -0.756486 -2.171671
H 2.508924 -0.769770 2.167925
H -2.513904 -0.778974 2.167995
H 2.510648 -0.764132 -2.171726
H -4.867547 0.208648 -2.167259
H 4.867316 0.195846 2.168126
H -4.872490 0.186050 2.168320
H 4.869041 0.201527 -2.167519


