%chk=000070985.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070985

1 1
 O   -2.740900     -0.8783000      5.8800001E-02
 O   -2.716600       1.421300      0.1587000    
 N    2.032400     -4.6999998E-02 -0.2825000    
 C    3.481300     -0.1822000     -0.4040000    
 C    1.503900       1.180700     -0.1869000    
 C    1.279000      -1.155100     -0.2713000    
 C  -0.6766000      0.2059000     -5.6600001E-02
 C   0.1303000       1.339500     -7.1199998E-02
 C  -0.1004000      -1.056800     -0.1573000    
 C    4.095300     -0.2911000      0.9776000    
 C   -2.119400      0.3406000      6.3900001E-02
 C   -4.168300     -0.8775000      0.1708000    
 H    3.703300      -1.069400      -1.007400    
 H    3.872400      0.6871000     -0.9443000    
 H    2.184600       2.023500     -0.1997000    
 H    1.786800      -2.109000     -0.3491000    
 H  -0.2865000       2.338700      6.6999998E-03
 H  -0.6789000      -1.974800     -0.1501000    
 H    3.876200      0.5971000       1.579100    
 H    5.182200     -0.3931000      0.9031000    
 H    3.706700      -1.161600       1.515800    
 H   -4.511800      -1.915000      0.1518000    
 H   -4.612200     -0.3432000     -0.6742000    
 H   -4.471600     -0.4227000       1.118300    


%chk=000070985-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000070985

1 1
O -2.837759 -0.886597 0.056287
O -2.744848 1.450215 0.162365
N 2.076043 -0.054601 -0.314242
C 3.581627 -0.171328 -0.386947
C 1.494912 1.188501 -0.201796
C 1.304643 -1.194336 -0.303868
C -0.703620 0.155721 -0.069827
C 0.107028 1.317491 -0.080070
C -0.088509 -1.114954 -0.184127
C 4.208200 -0.274078 1.015408
C -2.196107 0.331067 0.062013
C -4.326781 -0.853508 0.182733
H 3.811920 -1.061136 -0.996109
H 3.952779 0.714648 -0.928448
H 2.168285 2.048047 -0.217001
H 1.834011 -2.144951 -0.396917
H -0.356869 2.304125 0.004829
H -0.693543 -2.023840 -0.181520
H 3.994748 0.619740 1.626134
H 5.303334 -0.357164 0.909943
H 3.852424 -1.166133 1.558585
H -4.630753 -1.907191 0.155100
H -4.755284 -0.285802 -0.658714
H -4.604681 -0.376336 1.136188


