%chk=000048895.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048895

0 1
 O    1.422900     -3.1199999E-02   1.861200    
 O  -0.1250000      -1.792500      7.4500002E-02
 N    3.552800      8.2900003E-02 -3.5999998E-02
 C    1.247200      0.6532000      0.6177000    
 C    2.150000      2.1700000E-02 -0.4658000    
 C  -0.2295000      0.5920000      0.2904000    
 C    2.037800      0.7364000      -1.813800    
 C  -0.8320000     -0.6283000      3.7099998E-02
 C  -0.9479000       1.775300      0.2528000    
 C   -2.193600     -0.6671000     -0.2633000    
 C   -2.309500       1.736600     -4.7499999E-02
 C   -2.932200      0.5154000     -0.3057000    
 C  -0.8410000      -2.994500     -0.2017000    
 H    1.551600       1.693300      0.7901000    
 H    1.940800      -1.039500     -0.6168000    
 H    2.740500      0.3134000      -2.541000    
 H    1.033800      0.6292000      -2.236800    
 H    2.254100       1.806600      -1.720800    
 H  -0.4755000       2.732900      0.4509000    
 H    3.648600     -0.3639000      0.8753000    
 H    3.829300       1.055100      9.7999997E-02
 H   -2.744700      -1.576900     -0.4745000    
 H    1.554000     -0.9765000       1.675000    
 H   -2.884800       2.657200     -8.0700003E-02
 H   -3.992600      0.4868000     -0.5396000    
 H   -1.233100      -3.005100      -1.224300    
 H   -1.618800      -3.182400      0.5463000    
 H  -0.1246000      -3.819400     -0.1283000    


%chk=000048895-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000048895

0 1
O 1.580145 -0.406476 1.752248
O -0.197195 -1.892267 0.293065
N 3.622436 0.053911 -0.166312
C 1.274398 0.502457 0.624592
C 2.208892 0.141241 -0.590665
C -0.208986 0.510600 0.281934
C 2.078525 1.148552 -1.746977
C -0.937128 -0.700154 0.084382
C -0.911284 1.726538 0.120564
C -2.302949 -0.691729 -0.274015
C -2.278262 1.756512 -0.241736
C -2.970891 0.543932 -0.441901
C -0.880518 -3.175356 0.105473
H 1.570686 1.502099 0.994466
H 1.899553 -0.861075 -0.947176
H 2.762803 0.862830 -2.564584
H 1.049307 1.184376 -2.141828
H 2.352453 2.169889 -1.412756
H -0.372144 2.667507 0.283713
H 3.703898 -0.470633 0.716177
H 4.057889 0.981990 -0.073967
H -2.852424 -1.626187 -0.420746
H 1.141520 -1.274959 1.530944
H -2.794517 2.714704 -0.360455
H -4.030123 0.550151 -0.721302
H -1.244338 -3.280303 -0.933960
H -1.724653 -3.286025 0.812556
H -0.118491 -3.941423 0.310966


