%chk=000048910.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048910

0 1
 O    1.404200       1.968000      0.5186000    
 O   0.8828000       2.619400      -1.626900    
 N    3.469900      2.6600000E-02  0.7178000    
 N   -4.728400      0.5572000      0.7583000    
 C    2.535400      -1.730000     -0.7492000    
 C    3.757900      -1.240800      4.5600001E-02
 C    1.306200      -1.981700      0.1336000    
 C   0.1104000      -2.442500     -0.7042000    
 C   -1.155100      -2.684800      0.1234000    
 C    4.180100      -2.284600       1.079200    
 C   -2.356600      -3.121300     -0.7158000    
 C    3.517600       1.131800     -0.2263000    
 C    2.762600       2.334500      0.3165000    
 C   -3.564800      -3.418400      0.1595000    
 C   0.5682000       2.163500     -0.5385000    
 C  -0.8154000       1.744500     -0.2001000    
 C   -1.662500       1.263600      -1.198500    
 C   -1.268000       1.831300       1.116500    
 C   -2.962200      0.8697000     -0.8804000    
 C   -2.567600       1.437400       1.434600    
 C   -3.414800      0.9567000      0.4362000    
 H    2.800800      -2.666200      -1.258200    
 H    2.273600      -1.027200      -1.547500    
 H    4.601600      -1.117800     -0.6466000    
 H    1.519000      -2.753400      0.8809000    
 H    1.029300      -1.069600      0.6740000    
 H   0.3739000      -3.365700      -1.234900    
 H  -0.1056000      -1.687700      -1.470600    
 H   -1.409400      -1.769100      0.6706000    
 H  -0.9424000      -3.452800      0.8777000    
 H    4.142300      0.1963000       1.465200    
 H    4.305600      -3.268900      0.6154000    
 H    5.141500      -2.008900       1.528300    
 H    3.460200      -2.381200       1.898700    
 H   -2.100800      -4.018500      -1.291200    
 H   -2.611900      -2.335900      -1.436100    
 H    4.561100       1.409800     -0.4159000    
 H    3.076300      0.8697000      -1.192400    
 H    3.171200       2.642500       1.285800    
 H    2.858100       3.197500     -0.3531000    
 H   -3.859600      -2.535000      0.7343000    
 H   -3.350200      -4.229900      0.8623000    
 H   -4.415300      -3.720900     -0.4592000    
 H   -1.323200       1.185000      -2.228000    
 H  -0.6334000       2.212400       1.912300    
 H   -3.611900      0.4939000      -1.666700    
 H   -2.909400       1.511500       2.463800    
 H   -5.056200      0.6175000       1.713100    
 H   -5.341200      0.2032000      3.5799999E-02


%chk=000048910-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000048910

0 1
O 1.346263 2.144297 0.418940
O 0.786918 2.234798 -1.849125
N 3.528282 0.064294 0.606281
N -4.858387 0.620841 0.971114
C 2.737497 -1.980101 -0.614660
C 3.898388 -1.308104 0.174678
C 1.420848 -2.140893 0.177734
C 0.227517 -2.536523 -0.721099
C -1.097283 -2.694400 0.059163
C 4.297447 -2.123596 1.422716
C -2.297634 -3.062887 -0.842206
C 3.463495 1.099201 -0.435903
C 2.764534 2.378437 0.049568
C -3.622849 -3.196002 -0.059991
C 0.441473 2.044076 -0.650777
C -0.921096 1.694840 -0.193459
C -1.959629 1.592283 -1.159017
C -1.226397 1.437966 1.171027
C -3.263308 1.242207 -0.780801
C -2.527638 1.087847 1.560850
C -3.569885 0.980480 0.589921
H 3.095013 -2.968546 -0.971091
H 2.530650 -1.386370 -1.528753
H 4.784423 -1.285083 -0.512812
H 1.544889 -2.905984 0.971535
H 1.203002 -1.182911 0.688579
H 0.456429 -3.484686 -1.253667
H 0.093831 -1.762805 -1.506358
H -1.319553 -1.746361 0.591112
H -0.974222 -3.472871 0.842215
H 4.069791 0.369249 1.425559
H 4.515797 -3.171530 1.150984
H 5.202684 -1.701729 1.901041
H 3.481000 -2.118015 2.166307
H -2.080144 -4.013812 -1.371208
H -2.409201 -2.286796 -1.626945
H 4.470190 1.405412 -0.826013
H 2.904206 0.708145 -1.302087
H 3.215449 2.763402 0.980539
H 2.809355 3.147587 -0.743058
H -3.881826 -2.241237 0.436169
H -3.543628 -3.973719 0.723673
H -4.461941 -3.472828 -0.725959
H -1.715487 1.790537 -2.208201
H -0.426668 1.511330 1.913237
H -4.053688 1.164475 -1.537234
H -2.749381 0.888387 2.616367
H -5.083895 0.441009 1.945494
H -5.601732 0.537388 0.283322


