%chk=000014148.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014148

0 1
 O   -2.231600      -2.426300     -0.8464000    
 O  -0.1358000      -1.811300      0.8188000    
 N   0.5853000     -0.2650000     -0.7958000    
 N    2.632400      0.8618000      -1.157500    
 C   -1.672200      -1.115600     -0.9083000    
 C   -2.631000     -0.1365000     -0.3197000    
 C  -0.3232000      -1.118800     -0.1775000    
 C   -3.488200     -0.5311000      0.7076000    
 C   -2.670400       1.174100     -0.7961000    
 C    1.923100     -6.0999999E-03 -0.4145000    
 C    4.485100      0.4671000      0.3446000    
 C    2.395400     -0.6703000      0.6975000    
 C   -4.384900      0.3845000       1.258300    
 C   -3.567000       2.089600     -0.2451000    
 C    3.709100     -0.4222000       1.079800    
 C   -4.424200       1.694800      0.7821000    
 C    3.905000       1.077700     -0.7556000    
 C    5.893200      0.7534000      0.7279000    
 H   -1.525900     -0.8990000      -1.973600    
 H   -3.469800      -1.541400       1.107100    
 H   -2.008100       1.495000      -1.595700    
 H   0.2825000      0.2506000      -1.618400    
 H    1.859200      -1.369700       1.316000    
 H   -5.050200      7.8299999E-02   2.060300    
 H   -3.597600       3.110100     -0.6156000    
 H    4.118600     -0.9248000       1.951900    
 H   -5.121600       2.408000       1.211400    
 H    4.458900       1.782500      -1.368100    
 H   -1.642300      -3.017800      -1.345100    
 H    5.927300       1.573800       1.451600    
 H    6.366700     -0.1280000       1.173500    
 H    6.492500       1.032700     -0.1454000    


%chk=000014148-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014148

0 1
O -2.514111 -2.660322 -0.604088
O 0.058075 -2.628402 -0.003822
N 0.339561 -0.335051 -0.434360
N 2.088438 1.173188 -0.245310
C -1.843331 -1.427615 -0.966764
C -2.614005 -0.210912 -0.466589
C -0.382806 -1.503838 -0.406370
C -3.279826 -0.251561 0.782566
C -2.646283 0.979734 -1.234895
C 1.700947 -0.124998 -0.090270
C 4.343170 0.556811 0.503577
C 2.573785 -1.148333 0.361653
C -3.951600 0.892335 1.264445
C -3.315104 2.127286 -0.749250
C 3.902952 -0.785348 0.654477
C -3.965137 2.087227 0.504914
C 3.378724 1.491070 0.049236
C 5.766208 0.976552 0.810343
H -1.743009 -1.363067 -2.074111
H -3.285919 -1.189504 1.346651
H -2.175744 1.005634 -2.227268
H -0.146734 0.531932 -0.695867
H 2.205434 -2.169108 0.474408
H -4.469337 0.853279 2.229480
H -3.337440 3.041999 -1.351794
H 4.603281 -1.552462 1.005396
H -4.487972 2.973215 0.881890
H 3.649268 2.545177 -0.086329
H -1.795706 -3.290078 -0.299262
H 6.031554 0.762928 1.862570
H 6.491549 0.435082 0.174718
H 5.911417 2.057252 0.640027


