%chk=000110837.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000110837

0 1
 O   -1.713500     -0.5260000      0.6179000    
 O    2.667000      5.2999998E-03  1.9900000E-02
 O   -1.876900      3.1399999E-02  -1.609500    
 O   0.9803000     -0.7022000      -1.377700    
 N   -4.877100     -0.9846000     -0.5268000    
 N    2.119700      -3.328800      0.3568000    
 C  -0.6306000       1.408400     -0.1143000    
 C   0.7615000       1.341200     -0.1687000    
 C   -1.256800       2.589000      0.2856000    
 C    1.527500       2.454300      0.1771000    
 C   -1.458300      0.2628000     -0.4692000    
 C    1.445000      0.1225000     -0.5821000    
 C  -0.4908000       3.702300      0.6313000    
 C   0.9014000       3.634900      0.5771000    
 C   -2.519100      -1.688400      0.3959000    
 C    3.438600      -1.155000     -0.3082000    
 C   -2.646600      -2.434600       1.714600    
 C    4.762700      -1.068100      0.4343000    
 C   -3.836400      -1.295200     -0.1183000    
 C    2.702500      -2.369000      6.4300001E-02
 H   -2.341000       2.653700      0.3317000    
 H    2.613300       2.440700      0.1322000    
 H  -0.9782000       4.621800      0.9418000    
 H    1.497400       4.503000      0.8431000    
 H   -2.004100      -2.336600     -0.3236000    
 H    3.641500      -1.145100      -1.385900    
 H   -1.656700      -2.710300       2.094700    
 H   -3.113800      -1.805700       2.481600    
 H   -3.245300      -3.344800       1.605500    
 H    5.295800     -0.1516000      0.1590000    
 H    4.606300      -1.026900       1.518800    
 H    5.405300      -1.926600      0.2127000    


%chk=000110837-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000110837

0 1
O -1.618751 -0.444495 0.418582
O 2.407823 -0.106520 0.430691
O -2.686877 0.670166 -1.339979
O 0.767307 -0.760647 -1.094453
N -4.749643 -1.302295 1.631759
N 1.850979 -3.382279 1.462716
C -0.760591 1.688345 -0.229287
C 0.627949 1.439302 -0.019626
C -1.253312 3.011346 -0.145985
C 1.483842 2.515781 0.324991
C -1.771721 0.611022 -0.490683
C 1.211175 0.093797 -0.295123
C -0.390117 4.079041 0.182856
C 0.977749 3.827972 0.433722
C -2.511034 -1.632174 0.209708
C 3.102785 -1.405706 0.169275
C -1.712572 -2.867696 0.644008
C 4.553191 -1.226466 0.634380
C -3.750247 -1.437381 0.995404
C 2.402295 -2.494787 0.888469
H -2.317826 3.189262 -0.327357
H 2.546092 2.314807 0.486944
H -0.785526 5.097742 0.249533
H 1.649545 4.650871 0.698375
H -2.782981 -1.668795 -0.862279
H 3.036564 -1.621590 -0.914264
H -0.810876 -2.954967 0.017765
H -1.404048 -2.788676 1.698511
H -2.327681 -3.775962 0.520748
H 5.027537 -0.418801 0.053061
H 4.590186 -0.968526 1.704877
H 5.119385 -2.159891 0.474261


