%chk=000096759.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096759

0 1
 O  -0.5698000     -0.8029000      -1.994200    
 O    1.887900      0.3871000       1.860000    
 N   6.4199999E-02 -0.8785000      0.2320000    
 N    1.402200     -0.7919000     -7.3200002E-02
 C   -3.055000      0.1892000     -0.1419000    
 C   -4.409000      3.7500001E-02  0.2412000    
 C   -2.280700     -0.9548000     -0.3950000    
 C   -2.515500       1.480400     -0.2608000    
 C   -4.948800      -1.253700      0.3598000    
 C   -2.833300      -2.230100     -0.2719000    
 C   -5.183400       1.181400      0.4942000    
 C  -0.8783000     -0.8785000     -0.7941000    
 C   -4.164800      -2.379200      0.1046000    
 C    3.670200     -6.5099999E-02  0.4015000    
 C    4.123700      0.9984000     -0.3516000    
 C   -3.299500       2.605800     -5.2000000E-03
 C   -4.630900       2.456600      0.3717000    
 C    2.242200     -0.1361000      0.8064000    
 C    4.505300      -1.088100      0.8050000    
 C    5.469200       1.041600     -0.7173000    
 C    3.220800       2.105800     -0.7886000    
 C    5.850800      -1.044900      0.4392000    
 C    6.332700      2.0000000E-02 -0.3219000    
 H   -1.480700       1.642000     -0.5532000    
 H   -5.987200      -1.394000      0.6528000    
 H   -2.235300      -3.116800     -0.4676000    
 H   -6.226400       1.088500      0.7900000    
 H   -4.594600      -3.372100      0.2000000    
 H   -2.870200       3.598900     -0.1007000    
 H   -5.240700       3.333200      0.5704000    
 H  -0.1834000     -0.9458000       1.214200    
 H    4.136900      -1.920000       1.398200    
 H    5.861400       1.863500      -1.310400    
 H    1.712900      -1.221700     -0.9385000    
 H    2.761700       2.592700      7.8100003E-02
 H    3.763400       2.878700      -1.343800    
 H    2.434700       1.722200      -1.447200    
 H    6.523100      -1.840300      0.7472000    
 H    7.380200      5.3399999E-02 -0.6067000    


%chk=000096759-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096759

0 1
O -0.697078 -0.232382 -1.804875
O 2.222823 -0.055974 1.960275
N 0.123551 -0.294112 0.336960
N 1.416175 -0.201814 -0.184989
C -3.462072 0.156102 -0.495476
C -4.737171 -0.017600 0.177771
C -2.290569 -0.472829 0.080407
C -3.423962 0.956522 -1.687376
C -4.813441 -0.812255 1.368119
C -2.416077 -1.254259 1.243391
C -5.909828 0.611178 -0.358085
C -0.940447 -0.324532 -0.550830
C -3.674326 -1.425576 1.889985
C 3.834948 -0.044306 0.085110
C 4.883265 0.720693 0.688256
C -4.584982 1.557120 -2.181011
C -5.839180 1.386695 -1.515385
C 2.473714 -0.095159 0.705724
C 4.089301 -0.795179 -1.095490
C 6.152556 0.715197 0.056447
C 4.681453 1.533272 1.953905
C 5.361533 -0.788008 -1.701690
C 6.398424 -0.023661 -1.122143
H -2.474805 1.065735 -2.217202
H -5.786030 -0.937625 1.858567
H -1.542215 -1.778724 1.646404
H -6.865328 0.471063 0.161268
H -3.738253 -2.046523 2.789311
H -4.536227 2.161651 -3.093366
H -6.739004 1.864080 -1.918270
H 0.094097 -0.230922 1.360727
H 3.297508 -1.421772 -1.522545
H 6.962093 1.304747 0.502129
H 1.438135 -0.128335 -1.208121
H 4.466143 0.876898 2.814135
H 5.579527 2.135309 2.174627
H 3.814992 2.213842 1.871669
H 5.543108 -1.378613 -2.605650
H 7.393650 -0.007542 -1.579983


