%chk=000146846.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146846

0 1
 O   0.2359000      -1.058000     -0.1701000    
 O  -0.8390000       2.432900     -1.2600000E-02
 O    1.806700       2.682400      0.4800000    
 N  -1.2700000E-02   1.302900      0.1046000    
 C  -0.5184000      0.1062000     -0.5538000    
 C   -1.972200     -0.1732000     -0.2452000    
 C    2.180100      0.3922000      6.6000000E-02
 C    1.590400     -0.8616000     -0.1219000    
 C    1.322100       1.583000      0.2406000    
 C   -2.312800     -0.9666000      0.8504000    
 C   -2.972800      0.3620000      -1.056500    
 C    3.571700      0.5123000      0.1238000    
 C    2.392500      -1.999100     -0.2249000    
 C    4.369300     -0.6262000      1.7000000E-03
 C    3.781100      -1.879500     -0.1687000    
 C   -3.653800      -1.224600       1.134800    
 C   -4.313800      0.1041000     -0.7719000    
 C   -4.654300     -0.6892000      0.3237000    
 H  -0.3886000      0.2365000      -1.637100    
 H   -1.554600      -1.383900       1.507200    
 H   -2.720800      0.9815000      -1.913000    
 H    4.050400       1.476700      0.2688000    
 H    1.943900      -2.980300     -0.3551000    
 H    5.450900     -0.5372000      4.6900000E-02
 H    4.405500      -2.764100     -0.2559000    
 H   -3.919400      -1.839400       1.989900    
 H   -5.092900      0.5212000      -1.403300    
 H   -5.698400     -0.8893000      0.5457000    
 H   -1.231900       2.451500      0.8768000    


%chk=000146846-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000146846

0 1
O 0.200091 -1.040509 -0.295083
O -0.898366 2.337771 0.721343
O 1.703075 2.572083 1.110586
N -0.036832 1.198701 0.484713
C -0.587170 0.213451 -0.473194
C -2.039350 -0.113488 -0.227233
C 2.193967 0.339673 0.177062
C 1.602461 -0.880603 -0.250711
C 1.326314 1.454656 0.609956
C -2.487054 -0.454466 1.071931
C -2.946696 -0.115423 -1.309976
C 3.604471 0.448754 0.233620
C 2.400726 -1.992197 -0.586956
C 4.411314 -0.650893 -0.117501
C 3.805573 -1.869601 -0.518754
C -3.837858 -0.798159 1.281661
C -4.301048 -0.459069 -1.100006
C -4.747335 -0.801930 0.196329
H -0.427084 0.568743 -1.515672
H -1.778561 -0.439834 1.906670
H -2.597787 0.152313 -2.314886
H 4.035233 1.397094 0.570986
H 1.918257 -2.922825 -0.899052
H 5.501742 -0.569159 -0.073421
H 4.431350 -2.727929 -0.786304
H -4.185674 -1.059486 2.286907
H -5.002816 -0.457973 -1.940848
H -5.797443 -1.067364 0.362311
H -0.219401 3.010867 1.066421


