%chk=000027621.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027621

0 1
 O   0.9432000     -0.2120000      1.9999999E-04
 O   -2.614800      0.5235000      6.0999999E-03
 O   -3.938700      -1.359700     -9.8000001E-03
 N   -4.859700      0.7469000      1.9900000E-02
 C    3.333200     -0.3566000     -1.1200000E-02
 C    4.645300      0.4227000     -1.3700000E-02
 C    2.127700      0.5725000     -1.7700000E-02
 C  -0.2222000      0.6015000     -4.9000001E-03
 C    5.846300     -0.5082000      3.6499999E-02
 C   -1.448500     -0.2906000     -9.3999999E-03
 C   -3.811700     -0.1400000      4.1000000E-03
 H    3.285100      -1.023100     -0.8814000    
 H    3.281300      -1.009600      0.8692000    
 H    2.149200       1.222800      0.8647000    
 H    2.140700       1.197800     -0.9182000    
 H    4.679800       1.097700      0.8493000    
 H    4.707500       1.044200     -0.9145000    
 H  -0.2344000       1.249000      0.8803000    
 H  -0.2299000       1.248700     -0.8904000    
 H    5.831200      -1.119600      0.9444000    
 H    5.859500      -1.178200     -0.8291000    
 H    6.775100      7.0799999E-02  3.2299999E-02
 H   -1.435700     -0.9457000      0.8702000    
 H   -1.443900     -0.9255000     -0.9038000    
 H   -4.703500       1.749200      3.0999999E-02
 H   -5.822500      0.4273000      2.0800000E-02


%chk=000027621-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000027621

0 1
O 0.929852 -0.165845 0.009696
O -2.667803 0.540294 -0.002906
O -3.979500 -1.421510 0.006639
N -4.933807 0.726183 -0.005991
C 3.350513 -0.331469 0.009053
C 4.709659 0.406372 -0.003635
C 2.162795 0.634225 -0.001431
C -0.275390 0.664681 -0.001702
C 5.909105 -0.565623 0.007348
C -1.451676 -0.309186 0.003085
C -3.886027 -0.169531 -0.000637
H 3.274621 -0.999136 -0.870790
H 3.278301 -0.975466 0.906664
H 2.187798 1.301036 0.891075
H 2.185694 1.279051 -0.910029
H 4.772420 1.080691 0.875057
H 4.768986 1.056267 -0.900788
H -0.312513 1.322489 0.893840
H -0.306125 1.306721 -0.908866
H 5.892089 -1.205054 0.909824
H 5.886118 -1.232225 -0.875130
H 6.870794 -0.020872 -0.004178
H -1.443511 -0.947395 0.903411
H -1.442639 -0.958475 -0.889235
H -4.758245 1.727619 -0.011163
H -5.881910 0.361959 -0.004309


