%chk=000001892.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001892

0 1
 O  -0.3589000      -2.390000     -0.3533000    
 O    3.643200     -6.0500000E-02  0.4034000    
 O   -3.975200      0.1974000       1.224800    
 N   -1.645600      0.3066000     -0.4966000    
 N    1.694400       1.175000      0.1036000    
 N    1.657800      -1.245600      2.7200000E-02
 N  -0.5111000       2.209400     -0.2462000    
 C  -0.3447000     -4.9300000E-02 -0.2836000    
 C   0.3273000       1.133000     -0.1335000    
 C   -2.771800     -0.5691000     -0.7151000    
 C   0.2616000      -1.339300     -0.2162000    
 C    2.425000     -3.6400001E-02  0.1938000    
 C   -1.695400       1.676400     -0.4652000    
 C   -3.464400     -0.9636000      0.5825000    
 C    2.366200       2.459500      0.2565000    
 C    2.391700      -2.503500      0.1179000    
 H   -3.472500     -2.4800001E-02  -1.360300    
 H   -2.436900      -1.447900      -1.272600    
 H   -2.615200       2.227400     -0.6074000    
 H   -4.299600      -1.639000      0.3732000    
 H   -2.769300      -1.460300       1.267300    
 H    3.436700       2.333700      0.4378000    
 H    1.925000       2.992900       1.104000    
 H    2.229500       3.043500     -0.6589000    
 H    1.752200      -3.378600     -1.6600000E-02
 H    2.874000      -2.556100       1.099200    
 H    3.174200      -2.506900     -0.6475000    
 H   -4.410900     -9.7599998E-02   2.042500    


%chk=000001892-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000001892

0 1
O -0.176511 -2.549270 -0.421347
O 3.754858 -0.034042 0.267525
O -4.415460 0.492034 0.699531
N -1.665842 0.202251 -0.360358
N 1.733522 1.152005 0.131995
N 1.782531 -1.256044 -0.073639
N -0.522621 2.160853 -0.049434
C -0.307352 -0.135541 -0.222492
C 0.358369 1.087390 -0.036125
C -2.780876 -0.746166 -0.566467
C 0.364736 -1.407518 -0.256459
C 2.499595 -0.036590 0.118374
C -1.739028 1.581542 -0.246702
C -3.729040 -0.809065 0.632700
C 2.402673 2.453738 0.323496
C 2.614577 -2.481526 -0.083795
H -3.354484 -0.441114 -1.459602
H -2.333406 -1.738743 -0.744223
H -2.685154 2.112042 -0.293770
H -4.455462 -1.630369 0.462211
H -3.159155 -1.015944 1.561109
H 3.479502 2.261153 0.434010
H 2.007914 2.951507 1.224805
H 2.217236 3.104583 -0.547111
H 1.937731 -3.335693 -0.230333
H 3.159079 -2.575733 0.869765
H 3.354327 -2.429401 -0.899226
H -4.954959 0.549960 1.526263


