%chk=000081807.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081807

0 1
 O   -6.362900      0.3364000     -0.2094000    
 N    5.182500      0.2042000      0.1664000    
 N  -0.3664000      0.2429000     -0.5891000    
 N   -5.099200      0.3064000     -3.9600000E-02
 N  -0.9502000      0.2608000      0.5201000    
 C    3.783300      0.1993000     -2.4300000E-02
 C    3.078100      -1.001300     -0.1063000    
 C    3.106400       1.414400     -0.1300000    
 C    1.696000     -0.9869000     -0.2944000    
 C    1.019100      0.2281000     -0.4004000    
 C    1.724400       1.428700     -0.3181000    
 C    3.777700      -2.317000      3.5000001E-03
 C    5.739300      0.2205000       1.503500    
 C    6.076700      0.1788000     -0.9730000    
 C   -4.419000     -0.8914000      6.6900000E-02
 C   -2.342500      0.2759000      0.3299000    
 C   -3.040700     -0.9202000      0.2518000    
 C   -3.010400       1.487100      0.2250000    
 C   -4.389100       1.488800      4.0399998E-02
 C   -5.203000      -2.155400     -2.3000000E-02
 H    3.645100       2.356600     -6.7500003E-02
 H    1.139400      -1.919000     -0.3612000    
 H    1.206100       2.380600     -0.4001000    
 H    4.437700      -2.473400     -0.8551000    
 H    4.361200      -2.376600      0.9275000    
 H    3.067900      -3.151500      2.4000000E-02
 H    5.141700     -0.3832000       2.195100    
 H    6.758200     -0.1810000       1.516500    
 H    5.771900       1.246400       1.884500    
 H    6.152300     -0.8335000      -1.381700    
 H    5.723400      0.8471000      -1.765900    
 H    7.084500      0.5074000     -0.6968000    
 H   -2.514400      -1.867300      0.3357000    
 H   -2.474400       2.429600      0.2862000    
 H   -4.983300       2.386400     -5.0299998E-02
 H   -4.562600      -3.038000      7.7600002E-02
 H   -5.951300      -2.196800      0.7750000    
 H   -5.708400      -2.221400     -0.9919000    


%chk=000081807-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081807

0 1
O -6.587232 -0.803134 0.320500
N 5.314840 0.167912 -0.113020
N -0.366066 -0.008000 -0.314284
N -5.251801 -0.759709 0.366160
N -1.011794 -0.693764 0.613946
C 3.903584 0.088418 -0.121901
C 3.177672 -0.579921 0.938210
C 3.160060 0.740077 -1.156338
C 1.775929 -0.622813 0.874509
C 1.042787 -0.009471 -0.185296
C 1.760481 0.693054 -1.190151
C 3.870756 -1.141116 2.171050
C 5.983462 1.228353 -0.882500
C 6.150420 -1.037527 0.059161
C -4.539285 -0.023672 -0.608570
C -2.420427 -0.671903 0.471090
C -3.145327 0.014664 -0.549852
C -3.169420 -1.402235 1.435194
C -4.559913 -1.435445 1.369152
C -5.385892 0.664304 -1.640058
H 3.693089 1.255559 -1.960285
H 1.205332 -1.105656 1.675186
H 1.195119 1.173709 -1.995367
H 4.174686 -2.199552 2.051322
H 4.775844 -0.559692 2.421270
H 3.186629 -1.102521 3.035837
H 5.454497 2.187165 -0.756130
H 7.011726 1.350309 -0.496631
H 6.056235 1.001321 -1.970482
H 7.017812 -0.827465 0.713413
H 5.570234 -1.859275 0.497277
H 6.536067 -1.387612 -0.923737
H -2.587454 0.581366 -1.299766
H -2.644653 -1.939112 2.230032
H -5.199356 -1.972442 2.070618
H -4.750680 1.211007 -2.354698
H -6.010282 -0.068030 -2.183562
H -6.092579 1.365351 -1.159799


