%chk=000172924.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000172924

0 1
 O  -0.1878000      -1.973600      -1.497400    
 O    2.251700     -0.8432000      -1.723700    
 O    2.914200       1.621400     -0.6082000    
 O    3.326700      0.8820000       2.004100    
 O   -1.636300      -2.508600       1.547900    
 O   -2.631300       1.650800       1.153600    
 N   -1.710500      0.3539000     -0.5441000    
 N   -3.103500       2.114500      -1.044700    
 C   0.2671000      -1.148700     -0.4153000    
 C    1.254600     -0.1149000     -0.9939000    
 C  -0.9619000     -0.5559000      0.2863000    
 C    1.948900      0.7898000      3.7900001E-02
 C    2.684200     -1.8100001E-02   1.106500    
 C   -1.927400      -1.638600      0.7306000    
 C   -2.488800       1.389300     -3.9600000E-02
 H   0.7849000      -1.837100      0.2619000    
 H   0.7534000      0.5060000      -1.745900    
 H  -0.6556000     -1.5699999E-02   1.189600    
 H    1.218500       1.456300      0.5099000    
 H    3.462600     -0.6478000      0.6636000    
 H    2.000700     -0.6386000       1.691500    
 H   -1.735500      0.1827000      -1.544900    
 H   -2.925800      -1.639200      0.2589000    
 H   0.5988000      -2.357800      -1.921000    
 H    2.873700     -0.1932000      -2.093100    
 H    3.325700       2.177100      7.5800002E-02
 H    3.788100      0.3416000       2.668000    
 H   -2.972400       1.884800      -2.024000    
 H   -3.705200       2.902800     -0.8309000    


%chk=000172924-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000172924

0 1
O -0.293087 -1.624898 -1.730660
O 2.116658 -0.498500 -1.837986
O 3.041432 1.539760 -0.414605
O 3.614561 0.569394 1.971962
O -0.966260 -2.454599 1.755884
O -2.099979 2.089358 0.576174
N -2.018483 0.092267 -0.642927
N -3.332580 1.893936 -1.397249
C 0.209290 -0.988662 -0.500244
C 1.180130 0.137599 -0.894758
C -1.043891 -0.499483 0.265323
C 1.977410 0.774157 0.264023
C 2.628321 -0.237146 1.222935
C -1.653480 -1.633658 1.106160
C -2.462560 1.401903 -0.430968
H 0.728605 -1.747973 0.116481
H 0.628564 0.947237 -1.415946
H -0.765832 0.298768 0.989315
H 1.330490 1.468135 0.836358
H 3.131862 -1.040679 0.648669
H 1.875412 -0.677167 1.906021
H -2.086601 -0.369479 -1.555073
H -2.771583 -1.649271 1.115508
H 0.492906 -1.709558 -2.335390
H 2.882226 0.134928 -1.921771
H 3.733159 1.725063 0.277285
H 4.104599 0.006992 2.618797
H -3.701354 1.327821 -2.158129
H -3.668137 2.845756 -1.275787


