%chk=000082692.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082692

0 1
 I    7.312000      0.6021000     -0.1401000    
 O   -2.177600       1.789000     -0.1474000    
 O   0.2518000       1.371200      0.7574000    
 O   -5.874000      0.1135000     -0.3547000    
 O   -4.608600       1.905200     -0.4430000    
 N    1.169700     -0.6165000     -8.6099997E-02
 N   -4.751100      0.6682000     -0.2975000    
 C   -1.214500     -0.3606000      0.2455000    
 C   -2.331300      0.4417000      1.1800000E-02
 C   0.1205000      0.2163000      0.3240000    
 C   -3.600400     -0.1329000     -5.9200000E-02
 C    2.559100     -0.3408000     -9.8399997E-02
 C   -1.366900      -1.737600      0.4084000    
 C   -3.752700      -1.509700      0.1040000    
 C   -2.636000      -2.312100      0.3378000    
 C    3.007300      0.8938000      0.3387000    
 C    3.437200      -1.312500     -0.5469000    
 C    4.375500       1.165200      0.3267000    
 C    4.805300      -1.041200     -0.5588000    
 C    5.274500      0.1978000     -0.1221000    
 H  -0.5327000      -2.396900      0.6307000    
 H   0.9357000      -1.531300     -0.4629000    
 H   -4.724400      -1.994800      5.7599999E-02
 H   -2.755700      -3.383100      0.4736000    
 H    2.377200       1.692600      0.6996000    
 H    3.082300      -2.280800     -0.8890000    
 H    4.721200       2.136900      0.6711000    
 H    5.488600      -1.809300     -0.9124000    
 H   -1.239400       2.027000     -0.2095000    


%chk=000082692-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000082692

0 1
I 7.503536 0.613689 -0.036345
O -2.210759 1.799083 0.197132
O 0.251082 1.460458 0.199609
O -5.953202 0.206518 0.594820
O -4.855095 1.876924 -0.507671
N 1.228248 -0.640531 -0.060931
N -4.893870 0.720144 0.050004
C -1.230242 -0.442985 0.031630
C -2.366820 0.454997 0.078531
C 0.125388 0.177338 0.063755
C -3.675512 -0.122486 0.042892
C 2.610794 -0.289638 -0.048120
C -1.455746 -1.842609 -0.028544
C -3.866511 -1.515334 0.004901
C -2.754741 -2.381892 -0.038863
C 3.085332 1.039806 0.102857
C 3.540633 -1.353271 -0.197057
C 4.474992 1.288116 0.104870
C 4.926356 -1.102758 -0.195059
C 5.389767 0.223303 -0.042582
H -0.616276 -2.548375 -0.052134
H 1.045889 -1.637101 -0.188888
H -4.890743 -1.898243 0.013566
H -2.903407 -3.464127 -0.078150
H 2.374650 1.859167 0.214362
H 3.187767 -2.385908 -0.315155
H 4.832342 2.315176 0.221211
H 5.629020 -1.932210 -0.310388
H -1.180271 1.983147 0.238647


