%chk=000011297.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011297

0 1
 O  -0.2089000       2.304300      0.3850000    
 N   0.7726000      -2.226100     -4.4100001E-02
 N   -4.268700      0.7327000     -0.3787000    
 C  -0.8445000     -0.7530000      0.3326000    
 C   0.3732000     -3.9799999E-02  0.1501000    
 C   -2.176000     -0.1755000      0.6065000    
 C    1.371900     -0.9873000     -8.4700003E-02
 C  -0.5667000      -2.094700      0.2073000    
 C   0.7228000       1.325200      0.1622000    
 C   -2.970300      0.1370000     -0.6749000    
 C    2.708100     -0.6367000     -0.3087000    
 C    2.055400       1.690700     -6.0500000E-02
 C    3.031100      0.7232000     -0.2921000    
 H   -2.755500     -0.8972000       1.200200    
 H   -2.100000      0.7083000       1.249300    
 H   -1.200000      -2.968500      0.2734000    
 H    1.252700      -3.104900     -0.1807000    
 H   -3.127000     -0.7840000      -1.248200    
 H   -2.402700      0.8195000      -1.317700    
 H    3.468400      -1.389200     -0.4892000    
 H    2.337600       2.740700     -5.4000001E-02
 H    4.060100       1.029400     -0.4627000    
 H   -4.736200      0.9753000      -1.251200    
 H   -4.135700       1.607100      0.1277000    
 H   -1.079700       1.983500      0.1081000    


%chk=000011297-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000011297

0 1
O -0.203630 2.360548 0.266608
N 0.837597 -2.287875 0.045927
N -4.289895 0.773058 -0.433360
C -0.864006 -0.789894 0.362275
C 0.376397 -0.056899 0.127609
C -2.259387 -0.248670 0.579185
C 1.425925 -1.023085 -0.067662
C -0.532479 -2.143646 0.304433
C 0.731610 1.322618 0.074101
C -2.914863 0.319860 -0.711663
C 2.771269 -0.667345 -0.317554
C 2.063358 1.697586 -0.177117
C 3.068188 0.709145 -0.369999
H -2.925761 -1.046019 0.954286
H -2.267240 0.534928 1.370482
H -1.178177 -3.010506 0.433697
H 1.333299 -3.172335 -0.034863
H -2.962659 -0.492902 -1.458832
H -2.252837 1.106169 -1.152922
H 3.551003 -1.422000 -0.463305
H 2.309051 2.762795 -0.215909
H 4.096962 1.033393 -0.561213
H -4.872455 0.911866 -1.263427
H -4.357312 1.559988 0.219572
H -1.101958 1.989220 0.444651


