%chk=000103042.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103042

0 1
 O    2.948900      -1.149700     -0.5033000    
 O   -3.372300     -0.4742000     -0.3514000    
 O   0.3649000       4.663800      0.2621000    
 O    4.473000     -0.9736000       1.223800    
 O   -3.716400      -2.246200       1.090300    
 N  -9.1000004E-03   1.019300     -0.1415000    
 C   0.8873000      3.7700001E-02 -0.7511000    
 C   -1.379300      0.8224000     -0.6132000    
 C   0.4433000       2.378000     -0.4382000    
 C    2.116600     -0.1786000      0.1171000    
 C   -2.040800     -0.3303000      0.1253000    
 C  -0.1126000       3.362700      0.5781000    
 C    4.104100      -1.456000      0.1616000    
 C   -4.104200      -1.477900      0.2206000    
 C    4.875500      -2.487500     -0.6046000    
 C   -5.478900      -1.510000     -0.3757000    
 H   0.4107000     -0.9428000     -0.8689000    
 H    1.179400      0.3273000      -1.770100    
 H   -2.005600       1.705800     -0.4413000    
 H   -1.418100      0.6585000      -1.699000    
 H    1.536000       2.463100     -0.3946000    
 H   0.1776000       2.684600      -1.459300    
 H    1.816300     -0.5425000       1.107700    
 H    2.690000      0.7463000      0.2408000    
 H   -2.065700     -0.1197000       1.201800    
 H   -1.510700      -1.274700     -3.5100002E-02
 H   -1.205100       3.403200      0.5735000    
 H   0.2237000       3.110300       1.589600    
 H   7.4999998E-03   5.270100      0.9332000    
 H    4.281700      -3.400100     -0.6982000    
 H    5.797400      -2.725100     -6.6200003E-02
 H    5.138900      -2.096300      -1.590500    
 H   -5.988000     -0.5623000     -0.1838000    
 H   -6.056200      -2.315700      8.6700000E-02
 H   -5.412300      -1.701300      -1.449500    


%chk=000103042-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000103042

0 1
O 2.984137 -1.148721 -0.532116
O -3.449909 -0.477555 -0.376121
O 0.416888 4.653701 0.447071
O 4.291108 -0.999559 1.390926
O -3.702185 -2.099389 1.277593
N -0.036689 1.062877 -0.479192
C 0.946540 0.080669 -0.985072
C -1.442132 0.793227 -0.851608
C 0.379118 2.480568 -0.577406
C 2.010373 -0.200983 0.083599
C -2.062184 -0.226611 0.112257
C 0.024986 3.257202 0.699180
C 4.100716 -1.474624 0.249417
C -4.175923 -1.457545 0.313928
C 4.992591 -2.452480 -0.484637
C -5.562948 -1.600410 -0.274602
H 0.426586 -0.864361 -1.224704
H 1.445124 0.419566 -1.921876
H -2.017303 1.734266 -0.790331
H -1.544620 0.421922 -1.897171
H 1.473428 2.533334 -0.720677
H -0.082908 2.997364 -1.448419
H 1.566562 -0.663454 0.982571
H 2.546625 0.714522 0.393177
H -2.101253 0.164751 1.143939
H -1.509140 -1.183396 0.126990
H -1.064818 3.181483 0.904764
H 0.575605 2.823814 1.559503
H 0.265093 5.194063 1.261779
H 4.436682 -3.379779 -0.707166
H 5.871762 -2.685977 0.132546
H 5.315277 -2.024496 -1.449426
H -6.105738 -0.641805 -0.205023
H -6.116036 -2.380483 0.267594
H -5.497916 -1.863102 -1.344588


