%chk=000053146.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053146

0 1
 O    1.158500      -1.285800     -0.8434000    
 O   0.5504000      -1.101000      -2.152600    
 O  -4.8400000E-02   2.608900     -0.6693000    
 N  -0.2452000      0.5728000     -0.1581000    
 N  -0.2813000       1.823900      0.2576000    
 C    1.124300      8.9999998E-04 -0.2010000    
 C   -1.136500     -0.3224000      0.5965000    
 C    1.761100     -0.1389000       1.200200    
 C   -2.555500     -0.2658000      4.0600002E-02
 C    3.181900     -0.6828000       1.170000    
 C   -3.509300      -1.209900      0.7595000    
 H    1.769900      0.6539000     -0.8054000    
 H   -1.137700     -8.5800000E-02   1.670000    
 H  -0.8184000      -1.369900      0.5182000    
 H    1.776500      0.8301000       1.712800    
 H    1.174000     -0.8271000       1.819900    
 H   -2.547100     -0.5232000      -1.025900    
 H   -2.953700      0.7533000      0.1194000    
 H    3.592200     -0.7257000       2.184000    
 H    3.832300     -4.0600002E-02  0.5678000    
 H    3.213900      -1.693900      0.7525000    
 H   -3.176000      -2.248400      0.6665000    
 H   -3.574100     -0.9633000       1.824000    
 H   -4.513300      -1.134900      0.3303000    
 H    1.388000      -1.025400      -2.640800    


%chk=000053146-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000053146

0 1
O 0.851244 -1.245366 -0.586284
O 0.278877 -0.977616 -1.988012
O 0.492802 2.700768 -0.110152
N -0.238001 0.646973 0.466962
N -0.499408 1.999656 0.328738
C 1.057334 0.055406 0.051820
C -1.368823 -0.169800 0.964590
C 1.993959 -0.222153 1.248885
C -2.454966 -0.419613 -0.107054
C 3.415167 -0.632071 0.813400
C -3.601026 -1.288539 0.450902
H 1.517667 0.773060 -0.653548
H -1.807012 0.351743 1.834967
H -0.952766 -1.133010 1.308348
H 2.027630 0.711257 1.841546
H 1.542834 -1.001467 1.892575
H -1.990090 -0.905064 -0.983368
H -2.844207 0.559985 -0.443137
H 4.057368 -0.795627 1.696850
H 3.884614 0.158211 0.198994
H 3.398132 -1.563986 0.223218
H -3.233756 -2.283005 0.768116
H -4.083688 -0.810511 1.324629
H -4.380096 -1.448847 -0.315618
H 0.962711 -1.461384 -2.534065


