%chk=000047915.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047915

0 1
 O    3.603100     -0.3080000      -1.009300    
 O   -3.603100      0.3007000      -1.011000    
 N    2.964400      0.5522000     -0.1157000    
 N   -2.963400     -0.5551000     -0.1140000    
 C   0.7889000      0.9619000      0.8886000    
 C  -0.7881000     -0.9575000      0.8930000    
 C   8.9999998E-04  3.8999999E-03   1.773500    
 C  -0.1594000       1.827400      5.0099999E-02
 C   0.1594000      -1.825800      5.6499999E-02
 C   -1.222200       1.051700     -0.7277000    
 C    1.219600      -1.052000     -0.7267000    
 C    1.739800      0.1580000      2.0300001E-02
 C   -1.740100     -0.1574000      2.2399999E-02
 H    1.390100       1.622800       1.525800    
 H   -1.388400      -1.616100       1.533400    
 H  -0.6779000      0.5693000       2.424200    
 H   0.6803000     -0.5590000       2.425700    
 H   0.4131000       2.449200     -0.6490000    
 H  -0.6731000       2.519300      0.7310000    
 H  -0.4139000      -2.451100     -0.6388000    
 H   0.6751000      -2.514300      0.7393000    
 H  -0.8185000      0.7056000      -1.684100    
 H    2.004900      -1.773900     -0.9701000    
 H   -2.008700       1.772700     -0.9694000    
 H   0.8127000     -0.7073000      -1.682100    
 H    4.498200      7.0000000E-02  -1.039200    
 H   -4.497100     -7.9700001E-02  -1.041000    


%chk=000047915-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000047915

0 1
O 3.811678 -0.275132 -1.006554
O -3.812396 0.271592 -1.005781
N 2.996811 0.559959 -0.091610
N -2.996927 -0.560227 -0.088407
C 0.836115 0.947894 0.866619
C -0.835822 -0.944368 0.870377
C 0.000325 0.003351 1.769231
C -0.137225 1.858236 0.056489
C 0.137133 -1.857511 0.062961
C -1.208688 1.087683 -0.762558
C 1.207828 -1.089621 -0.759592
C 1.756602 0.123891 -0.029665
C -1.756822 -0.123590 -0.028374
H 1.477100 1.603539 1.484543
H -1.476477 -1.597832 1.490951
H -0.660526 0.605142 2.422299
H 0.661532 -0.596093 2.424102
H 0.438499 2.518572 -0.617710
H -0.652438 2.512475 0.787437
H -0.438927 -2.520397 -0.608436
H 0.653000 -2.508965 0.795945
H -0.779731 0.748528 -1.726362
H 2.045889 -1.756965 -1.025925
H -2.047077 1.754155 -1.030117
H 0.777743 -0.753455 -1.723925
H 4.705162 0.143589 -0.911460
H -4.705762 -0.146948 -0.908778


