%chk=000096879.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096879

0 1
 O    2.635200      -1.482900      0.7178000    
 O    1.667500      -1.449400      -1.370500    
 N   0.6172000       1.228400     -0.4730000    
 N    1.743800       2.627200      0.7966000    
 C  -0.4397000      0.7369000      -1.363000    
 C   -1.581800      0.1539000     -0.6009000    
 C    1.670100      0.5125000     -1.5600000E-02
 C   0.6874000       2.484500      2.7500000E-02
 C   -2.647400      0.9655000     -0.2119000    
 C   -1.583900      -1.202700     -0.2769000    
 C    2.360900       1.401500      0.7740000    
 C    1.965500     -0.8526000     -0.3090000    
 C   -3.715200      0.4204000      0.5013000    
 C   -2.651600      -1.747900      0.4361000    
 C   -3.717300     -0.9362000      0.8252000    
 C    2.989400      -2.858900      0.5421000    
 H  -1.4400000E-02  3.2900002E-02  -2.082400    
 H  -0.7731000       1.595500      -1.960800    
 H  -4.0899999E-02   3.254200     -0.1889000    
 H   -2.658700       2.024200     -0.4572000    
 H  -0.7719000      -1.855400     -0.5796000    
 H    3.272400       1.228400       1.328600    
 H   -4.545000       1.052300      0.8042000    
 H   -2.654700      -2.804800      0.6861000    
 H   -4.549000      -1.360900       1.379800    
 H    3.506100      -3.196200       1.444300    
 H    3.662600      -2.967000     -0.3131000    
 H    2.088300      -3.463400      0.4032000    


%chk=000096879-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096879

0 1
O 3.160709 -1.399897 0.530692
O 1.376751 -1.768072 -0.930081
N 0.608703 1.114129 -0.400611
N 1.719452 2.547393 0.980358
C -0.452093 0.623912 -1.328335
C -1.709181 0.145706 -0.607234
C 1.691112 0.395054 0.154978
C 0.673517 2.389247 0.129492
C -2.773832 1.044884 -0.348299
C -1.827546 -1.204832 -0.191522
C 2.353506 1.310682 0.998622
C 2.011621 -0.995353 -0.156530
C -3.936186 0.607911 0.325655
C -2.989491 -1.642548 0.482563
C -4.045143 -0.738313 0.744739
C 3.580287 -2.800180 0.291910
H -0.012136 -0.192996 -1.919904
H -0.692038 1.465534 -2.002252
H -0.045472 3.165453 -0.123238
H -2.697972 2.089225 -0.678327
H -1.009081 -1.901778 -0.403721
H 3.241671 1.125283 1.596599
H -4.753757 1.311124 0.519486
H -3.073725 -2.688220 0.799158
H -4.946233 -1.079997 1.266302
H 4.490535 -2.922544 0.895086
H 3.787041 -2.962462 -0.779272
H 2.790782 -3.498347 0.617685


