%chk=000043027.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043027

0 1
 O    2.164000     -0.2063000     -0.2261000    
 O    1.665200       1.161600       1.544200    
 N   5.4400001E-02  0.6266000     -1.6500000E-02
 N   -2.266600      -1.008700      0.1873000    
 C  -0.4422000     -2.6500000E-02  -1.216200    
 C   -1.114700       1.164100      0.6526000    
 C   -1.431300       1.016800      -1.757400    
 C   -1.877700       1.811700     -0.5117000    
 C   -1.164200      -1.311600     -0.7502000    
 C   -1.881500     -4.3400001E-02   1.238900    
 C    1.324400      0.5764000      0.5190000    
 C   -2.830200      -2.225900      0.7603000    
 C    3.507600     -0.3202000      0.2557000    
 C    4.292800      -1.214500     -0.6799000    
 H   0.3570000     -0.2601000      -1.925300    
 H  -0.8465000       1.876100       1.438800    
 H   -2.273700      0.5709000      -2.295600    
 H  -0.9198000       1.697000      -2.449000    
 H   -1.569800       2.857800     -0.6280000    
 H   -2.963400       1.800600     -0.3726000    
 H  -0.4336000      -1.977100     -0.2712000    
 H   -1.567800      -1.833400      -1.626000    
 H   -2.783900      0.3172000       1.746400    
 H   -1.249200     -0.5362000       1.989700    
 H   -2.100800      -2.770300       1.370400    
 H   -3.185700      -2.895100     -3.0999999E-02
 H   -3.697100      -1.990700       1.387500    
 H    3.968000      0.6735000      0.2911000    
 H    3.498800     -0.7541000       1.261800    
 H    5.326700      -1.323900     -0.3407000    
 H    3.833300      -2.206600     -0.7404000    
 H    4.295000     -0.8030000      -1.694600    


%chk=000043027-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000043027

0 1
O 2.218529 -0.190392 -0.264075
O 1.678124 1.052549 1.669952
N 0.094994 0.628640 -0.006773
N -2.263765 -0.988710 0.199368
C -0.427040 -0.075594 -1.204773
C -1.108163 1.162592 0.675943
C -1.441235 0.965536 -1.765627
C -1.890711 1.794791 -0.512374
C -1.143935 -1.356948 -0.702733
C -1.865704 -0.050397 1.279674
C 1.335171 0.541602 0.567162
C -3.010543 -2.154836 0.697995
C 3.619736 -0.264911 0.232395
C 4.378065 -1.165036 -0.739570
H 0.389401 -0.332371 -1.894893
H -0.819712 1.873602 1.465094
H -2.296394 0.461528 -2.245381
H -0.946526 1.612229 -2.511093
H -1.616553 2.858459 -0.621848
H -2.978581 1.725016 -0.348243
H -0.384349 -2.008932 -0.200213
H -1.558840 -1.921775 -1.559525
H -2.781551 0.293404 1.797183
H -1.202685 -0.531415 2.043074
H -2.404274 -2.820699 1.363187
H -3.368464 -2.760792 -0.154303
H -3.892783 -1.815310 1.270742
H 4.037500 0.758047 0.269354
H 3.612177 -0.667390 1.261472
H 5.433491 -1.254074 -0.423058
H 3.936261 -2.176215 -0.764958
H 4.355857 -0.749495 -1.761857


