%chk=000063118.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063118

0 1
 O  -0.3399000      -2.026200     -0.2943000    
 N   0.1130000      0.2821000     -0.1679000    
 N   -1.706800       1.798800      5.2499998E-02
 C    1.520000      7.1300000E-02 -0.3712000    
 C    2.368400     -0.1367000      0.7102000    
 C  -0.4338000       1.559800     -2.7400000E-02
 C  -0.7119000     -0.8628000     -0.1595000    
 C    3.730800     -0.3402000      0.4901000    
 C   -2.161500     -0.6008000     -3.8600001E-02
 C   -2.598400      0.7217000      3.7400000E-02
 C    2.016100      7.8599997E-02  -1.670200    
 C    1.831500     -0.1435000       2.107300    
 C    4.235700     -0.3344000     -0.8102000    
 C    3.378400     -0.1250000      -1.890300    
 C   0.4728000       2.766900      0.1016000    
 C   -3.078900      -1.658200     -2.6699999E-02
 C    4.670900     -0.5666000       1.628700    
 C   -3.971700      0.9775000      0.1266000    
 C   -4.444000      -1.389700      6.3199997E-02
 C   -4.890800     -7.2700001E-02  0.1387000    
 H    1.356600      0.2410000      -2.518500    
 H    1.909100      -1.149400       2.533500    
 H    2.391100      0.5566000       2.737200    
 H   0.7836000      0.1566000       2.185900    
 H    5.294400     -0.4905000     -0.9997000    
 H    3.771400     -0.1201000      -2.902800    
 H    1.107700       2.852700     -0.7842000    
 H    1.107900       2.659700      0.9850000    
 H  -0.1148000       3.684200      0.2006000    
 H   -2.751600      -2.692300     -8.8600002E-02
 H    5.684300     -0.7913000       1.278000    
 H    4.735700      0.3272000       2.257400    
 H    4.348900      -1.418600       2.236300    
 H   -4.334500       2.000600      0.1912000    
 H   -5.158800      -2.207200      7.2600000E-02
 H   -5.954000      0.1375000      0.2088000    


%chk=000063118-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000063118

0 1
O -0.162659 -1.996758 -0.083798
N 0.099906 0.338734 -0.204145
N -1.766437 1.859466 -0.047972
C 1.539723 0.154780 -0.370972
C 2.350120 -0.158252 0.751903
C -0.464435 1.636486 -0.160750
C -0.702171 -0.853035 -0.088363
C 3.750610 -0.347726 0.539351
C -2.149736 -0.594901 0.017743
C -2.632369 0.752658 0.030411
C 2.074841 0.273393 -1.671642
C 1.741316 -0.331520 2.129636
C 4.283884 -0.211478 -0.766003
C 3.457839 0.095371 -1.869862
C 0.472494 2.818681 -0.229272
C -3.059121 -1.681247 0.108771
C 4.669092 -0.706551 1.695059
C -4.031983 0.987294 0.133812
C -4.438164 -1.434936 0.208252
C -4.922436 -0.095360 0.220624
H 1.405726 0.483823 -2.512815
H 1.521374 -1.400534 2.315671
H 2.422500 0.013840 2.925875
H 0.788703 0.214836 2.229673
H 5.359413 -0.359693 -0.919140
H 3.885725 0.181974 -2.874093
H 0.985346 2.879326 -1.205405
H 1.260954 2.756505 0.541941
H -0.123118 3.730145 -0.078293
H -2.653237 -2.698109 0.097099
H 5.700463 -0.874923 1.342293
H 4.702107 0.094725 2.458446
H 4.332635 -1.625768 2.209881
H -4.380081 2.024529 0.143086
H -5.142678 -2.270569 0.276506
H -5.999247 0.091394 0.299193


