%chk=000125213.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125213

0 1
 O    4.051300      -2.513100      0.2397000    
 O   -5.065200      -3.581900     -0.3417000    
 O  -0.6084000       3.292800     -0.3234000    
 O    6.482000      -1.261200     -0.2600000    
 N   -1.692700       1.656700      0.9220000    
 C   -3.911000       1.936700     -0.1344000    
 C   -2.980100       2.307800       1.017300    
 C   -4.219700      0.4606000     -0.1897000    
 C   -3.402400     -0.3771000     -0.9318000    
 C   -5.315200     -3.0900000E-02  0.5028000    
 C   -3.687900      -1.741500     -0.9831000    
 C   -5.600700      -1.395300      0.4518000    
 C  -0.6132000       2.211100      0.2552000    
 C    2.977400      0.9289000     -0.2667000    
 C   -4.787000      -2.250600     -0.2912000    
 C    1.730500       1.714300     -0.2699000    
 C   0.5866000       1.328200      0.3142000    
 C    2.921700     -0.4319000     -1.2800000E-02
 C    4.102400      -1.174700     -8.9999996E-03
 C    4.181300       1.567300     -0.5170000    
 C    5.322500     -0.5464000     -0.2594000    
 C    5.361800      0.8247000     -0.5133000    
 C    4.165800      -2.924300       1.600500    
 H   -4.847100       2.501800     -4.0700000E-02
 H   -3.470300       2.250300      -1.089900    
 H   -2.828500       3.392700       1.031500    
 H   -3.416000       2.015700       1.979000    
 H   -1.597900      0.7497000       1.369900    
 H   -2.545400      8.2999999E-03  -1.476800    
 H   -5.953200      0.6272000       1.085600    
 H   -3.050500      -2.402700      -1.564000    
 H   -6.459600      -1.779400      0.9955000    
 H    1.786500       2.671100     -0.7841000    
 H   0.4876000      0.3980000      0.8614000    
 H    1.989600     -0.9602000      0.1634000    
 H    4.228300       2.634900     -0.7151000    
 H    6.305400       1.326600     -0.7096000    
 H   -5.858200      -3.758500      0.1931000    
 H    7.223600     -0.6617000     -0.4509000    
 H    3.341500      -2.517000       2.194500    
 H    5.125000      -2.605500       2.020500    
 H    4.115000      -4.016100       1.634100    


%chk=000125213-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125213

0 1
O 4.191000 -2.549227 0.367848
O -5.525995 -3.605300 -0.027472
O -0.514945 3.496799 0.175762
O 6.686496 -1.198521 -0.160918
N -1.870045 1.645873 0.613210
C -4.108784 1.975554 -0.490424
C -3.122898 2.406421 0.636216
C -4.521749 0.514591 -0.386538
C -3.837638 -0.497189 -1.113936
C -5.572367 0.112969 0.477807
C -4.179934 -1.859331 -0.984277
C -5.930526 -1.245376 0.620232
C -0.634128 2.241657 0.367521
C 3.028035 0.972942 0.087704
C -5.228109 -2.232567 -0.112892
C 1.785155 1.750903 0.136110
C 0.515637 1.293477 0.353812
C 3.078198 -0.434942 0.292210
C 4.285246 -1.155802 0.232720
C 4.251466 1.652826 -0.168358
C 5.497854 -0.453568 -0.050693
C 5.467442 0.947588 -0.234021
C 5.151872 -3.235372 1.258412
H -4.998054 2.631755 -0.422346
H -3.627223 2.174183 -1.465359
H -2.843672 3.467329 0.514163
H -3.616546 2.286686 1.621332
H -1.920984 0.632126 0.733901
H -3.034222 -0.212578 -1.804112
H -6.125880 0.872438 1.043829
H -3.657915 -2.637260 -1.549363
H -6.752056 -1.530916 1.290665
H 1.874874 2.836087 -0.021728
H 0.307434 0.228032 0.522885
H 2.171618 -1.011383 0.500719
H 4.243198 2.737763 -0.319947
H 6.402050 1.484565 -0.444735
H -6.278251 -3.764472 0.594986
H 7.441779 -0.609050 -0.408530
H 5.087363 -2.823886 2.284254
H 6.181908 -3.143027 0.879512
H 4.828897 -4.287396 1.257339


