%chk=000002230.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002230

0 1
 O    2.113900     -0.8960000      0.3784000    
 O    2.388300       1.164700     -0.6403000    
 N   -1.992500     -0.6669000     -0.3798000    
 C   -2.525700      0.3879000      0.4924000    
 C  -0.5636000     -0.9044000     -9.9100001E-02
 C   -1.808400       1.720600      0.2279000    
 C   0.2413000      0.3621000     -3.7099998E-02
 C  -0.3205000       1.571300      9.6500002E-02
 C   -2.758400      -1.903400     -0.2355000    
 C    1.698800      0.2848000     -0.1476000    
 C    3.527100      -1.120700      0.3441000    
 H   -2.416500      0.1091000       1.549500    
 H   -3.596800      0.5339000      0.3064000    
 H  -0.1643000      -1.544900     -0.8955000    
 H  -0.4455000      -1.440100      0.8525000    
 H   -2.032300       2.413800       1.046700    
 H   -2.191500       2.172800     -0.6951000    
 H   0.2743000       2.479400      0.1196000    
 H   -2.375000      -2.674500     -0.9128000    
 H   -3.807000      -1.739400     -0.5075000    
 H   -2.725500      -2.294700      0.7877000    
 H    3.883700      -1.130600     -0.6903000    
 H    3.727100      -2.096700      0.7940000    
 H    4.046800     -0.3526000      0.9250000    


%chk=000002230-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000002230

0 1
O 2.170686 -1.019666 0.111243
O 2.502455 1.288384 0.099831
N -1.994946 -0.690765 -0.278686
C -2.576006 0.442966 0.473154
C -0.572153 -0.924786 0.053078
C -1.874299 1.755394 0.067594
C 0.226874 0.366094 0.061553
C -0.375808 1.590601 0.047271
C -2.789686 -1.926898 -0.176407
C 1.712134 0.310604 0.089774
C 3.642422 -1.177277 0.140797
H -2.483184 0.300150 1.581563
H -3.654631 0.501461 0.239262
H -0.142639 -1.618760 -0.692040
H -0.450520 -1.429202 1.048468
H -2.155749 2.572375 0.762064
H -2.219247 2.066824 -0.939451
H 0.259939 2.485844 0.031900
H -2.347544 -2.706884 -0.822431
H -3.820163 -1.738030 -0.526601
H -2.845313 -2.335747 0.864901
H 4.094606 -0.716802 -0.753867
H 3.809151 -2.263674 0.156044
H 4.061421 -0.696707 1.041085


