%chk=000006317.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006317

0 1
 O   -1.497700       1.260800      -1.711700    
 O    5.017400      0.2464000      0.8298000    
 O    4.594200      -1.597000     -0.2931000    
 N   -3.558100      0.4365000      0.1224000    
 N    4.229100     -0.5080000      0.2112000    
 C   -1.222700       1.070000     -0.3245000    
 C   -2.171700      2.0000000E-02  0.2661000    
 C   -4.461100     -0.5670000      0.6839000    
 C   0.2242000      0.6513000     -0.1825000    
 C   -4.274400      -1.904100     -2.7500000E-02
 C   -5.901200     -7.8599997E-02  0.5631000    
 C    1.103100       1.476500      0.4977000    
 C   0.6382000     -0.5481000     -0.7358000    
 C    2.437100       1.090400      0.6286000    
 C    1.972000     -0.9342000     -0.6049000    
 C    2.871500     -0.1149000      7.7200003E-02
 H   -1.384600       2.034800      0.1724000    
 H   -1.924500     -0.1500000       1.321500    
 H   -2.011300     -0.9134000     -0.2788000    
 H   -4.248700     -0.7013000       1.752400    
 H   -3.700100       1.329900      0.5928000    
 H   -5.092300      -2.587800      0.2293000    
 H   -4.279000      -1.791100      -1.117700    
 H   -3.352100      -2.412700      0.2709000    
 H   -6.040400      0.8727000       1.088800    
 H   -6.595000     -0.8031000       1.003100    
 H   -6.188500      6.8099998E-02 -0.4843000    
 H   0.7764000       2.417100      0.9313000    
 H  -4.0899999E-02  -1.192200      -1.286000    
 H   -2.439400       1.489800      -1.791900    
 H    3.109000       1.754100       1.166800    
 H    2.275500      -1.878100      -1.050600    


%chk=000006317-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000006317

0 1
O -1.807154 0.559799 -1.708574
O 4.972558 -0.022901 1.122227
O 4.706867 -1.580079 -0.523002
N -3.554120 0.553580 0.278451
N 4.263421 -0.621296 0.221469
C -1.250938 1.061549 -0.463505
C -2.136934 0.494309 0.707172
C -4.452423 -0.568958 0.699236
C 0.199988 0.642683 -0.315289
C -4.152955 -1.838611 -0.125874
C -5.915594 -0.119416 0.514227
C 1.026938 1.277100 0.649067
C 0.732093 -0.402394 -1.111859
C 2.360365 0.867773 0.835012
C 2.064974 -0.823250 -0.942518
C 2.860649 -0.183998 0.034590
H -1.310647 2.174423 -0.437317
H -1.930914 1.043412 1.649366
H -1.865341 -0.563331 0.868319
H -4.292064 -0.803812 1.777758
H -3.981299 1.468043 0.478766
H -4.778670 -2.678920 0.225628
H -4.369746 -1.659740 -1.194552
H -3.096026 -2.147866 -0.041083
H -6.154673 0.757468 1.146173
H -6.607357 -0.933298 0.792081
H -6.104532 0.148831 -0.541631
H 0.629532 2.103334 1.250737
H 0.084633 -0.852388 -1.869028
H -2.792022 0.467804 -1.479412
H 3.015973 1.340471 1.570869
H 2.499418 -1.623522 -1.547503


