%chk=000041935.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041935

0 1
 O  -0.2992000      -2.255000      1.2200000E-02
 O   -1.766200       2.883100      4.0700000E-02
 O    2.396100      -2.246700       1.229900    
 O    2.490400      -2.210300     -0.9630000    
 N    2.243400      -1.661900      0.1343000    
 C   0.4078000      1.0400000E-02  8.3300002E-02
 C   1.2300000E-02   1.349700      9.0599999E-02
 C    1.768100     -0.3162000      0.1362000    
 C    2.726400      0.6960000      0.1959000    
 C   -2.031600     -0.7093000     -3.6100000E-02
 C   -2.427000      0.6300000     -2.9300001E-02
 C  -0.5997000      -1.068000      2.0000000E-02
 C   -1.419600       1.708500      3.4100000E-02
 C   0.9772000       2.362400      0.1511000    
 C    4.190600      0.3933000      0.2559000    
 C    2.331700       2.032400      0.2036000    
 C   -2.996500      -1.721900     -9.6400000E-02
 C   -3.787400      0.9568000     -8.3099999E-02
 C    4.879800      0.6141000      -1.086300    
 C   -4.351000      -1.391900     -0.1501000    
 C   -4.745600     -5.5399999E-02 -0.1436000    
 H   0.6952000       3.411800      0.1584000    
 H    4.654600       1.052500       1.002200    
 H    4.411200     -0.6167000      0.6140000    
 H    3.068000       2.830700      0.2516000    
 H   -2.717900      -2.772200     -0.1030000    
 H   -4.120700       1.991100     -7.9200000E-02
 H    4.457100     -3.6600001E-02  -1.859100    
 H    5.948300      0.3915000      -1.002200    
 H    4.778400       1.650200      -1.426200    
 H   -5.099000      -2.178000     -0.1970000    
 H   -5.800800      0.1987000     -0.1855000    


%chk=000041935-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000041935

0 1
O -0.241607 -2.304717 -0.072207
O -1.821494 2.973158 0.109668
O 2.456208 -2.241392 1.285975
O 2.668726 -2.145731 -0.987130
N 2.301999 -1.665397 0.148002
C 0.401327 0.012998 0.094601
C -0.015923 1.376463 0.129003
C 1.791618 -0.258966 0.158783
C 2.777368 0.755527 0.249573
C -2.049969 -0.712136 -0.061726
C -2.464915 0.650419 -0.017978
C -0.606641 -1.089819 -0.014076
C -1.464956 1.752909 0.076608
C 0.947509 2.408177 0.221838
C 4.267007 0.458435 0.273499
C 2.316360 2.098605 0.279357
C -3.021620 -1.739327 -0.154398
C -3.844602 0.967788 -0.066574
C 4.883794 0.457129 -1.154356
C -4.392174 -1.415739 -0.201477
C -4.804859 -0.059315 -0.157241
H 0.591155 3.442197 0.250607
H 4.771709 1.227085 0.887375
H 4.466161 -0.514698 0.757142
H 3.056936 2.902520 0.354477
H -2.677065 -2.777581 -0.187794
H -4.134923 2.022458 -0.031733
H 4.421083 -0.325180 -1.779794
H 5.968534 0.258404 -1.096975
H 4.738281 1.432482 -1.652801
H -5.139883 -2.212516 -0.272357
H -5.870743 0.188862 -0.193991


