%chk=000027240.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027240

0 1
 O   0.1285000     -0.9059000     -0.2957000    
 O   -2.056900      -2.686700     -0.3386000    
 O    2.703500      -1.948700     -0.2286000    
 N    4.503100       2.489800      0.2256000    
 C   -1.942000      -1.684000      0.6788000    
 C  -0.4507000      -1.392700      0.9066000    
 C   -2.725600     -0.4786000      0.2822000    
 C    1.212700     -7.6399997E-02 -0.1689000    
 C   -3.316300      0.3220000       1.259800    
 C   -2.868100     -0.1520000      -1.066300    
 C    2.498100     -0.6052000     -0.1350000    
 C    1.008400       1.295800     -7.3200002E-02
 C    3.593200      0.2488000     -3.8999999E-03
 C   -4.049500       1.449200      0.8889000    
 C   -3.601100      0.9752000      -1.437300    
 C    3.395900       1.626200      9.2500001E-02
 C    2.103600       2.149800      5.7999998E-02
 C   -4.191700       1.775800     -0.4597000    
 C    4.055000      -2.402300     -0.1850000    
 H   -2.371400      -2.117700       1.589900    
 H  -0.3323000     -0.6685000       1.722900    
 H   7.1999997E-02  -2.316200       1.181300    
 H   -3.210800      7.9499997E-02   2.313900    
 H   -2.409600     -0.7507000      -1.848600    
 H   4.1000000E-03   1.709000     -9.9799998E-02
 H    4.620300     -0.1000000      2.8999999E-02
 H   -4.508600       2.073100       1.650100    
 H   -3.709600       1.231400      -2.487200    
 H   -1.567600      -3.469900     -3.4100000E-02
 H    1.936600       3.221300      0.1324000    
 H   -4.761600       2.654200     -0.7485000    
 H    4.360000       3.488600      0.2946000    
 H    5.441000       2.112200      0.2498000    
 H    4.527700      -2.171400      0.7757000    
 H    4.634100      -2.029100      -1.036500    
 H    4.030900      -3.493600     -0.2720000    


%chk=000027240-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000027240

0 1
O 0.044436 1.146418 0.275838
O -0.415565 -1.518584 1.451916
O 1.279358 -1.081615 -0.718858
N 5.677805 1.115600 -0.320136
C -1.336547 -0.397707 1.666533
C -0.568501 0.944475 1.619236
C -2.558559 -0.450138 0.748033
C 1.455994 1.127425 0.199383
C -3.854117 -0.572898 1.308080
C -2.425551 -0.408698 -0.665692
C 2.116530 -0.000600 -0.366297
C 2.233216 2.237688 0.585290
C 3.515152 -0.006210 -0.544489
C -4.999599 -0.644770 0.481766
C -3.567955 -0.481283 -1.491865
C 4.290691 1.121198 -0.145837
C 3.633552 2.245677 0.426328
C -4.859114 -0.598803 -0.923358
C 1.895929 -2.269781 -1.318727
H -1.683593 -0.523281 2.710788
H -1.257187 1.792431 1.789973
H 0.227815 0.937942 2.387891
H -3.967505 -0.621272 2.398898
H -1.430398 -0.301734 -1.108560
H 1.719421 3.111345 1.001256
H 4.019314 -0.874933 -0.980274
H -5.994337 -0.741868 0.932000
H -3.453659 -0.442311 -2.581582
H 0.080738 -1.374425 0.591674
H 4.215677 3.122233 0.732516
H -5.743490 -0.656446 -1.568451
H 6.237121 1.913893 -0.036498
H 6.153855 0.313683 -0.721006
H 2.621577 -2.735612 -0.625330
H 2.391113 -2.012697 -2.273347
H 1.061679 -2.962043 -1.503993


