%chk=000032141.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032141

0 1
 O   0.8420000      -2.154300     -0.3630000    
 O    2.548100       2.861600      0.3282000    
 N   -1.028200     -0.1770000     -0.2389000    
 C   -3.457500      0.1519000     -0.3913000    
 C   -3.730100     -0.8348000      0.7521000    
 C   -4.566300       1.209500     -0.4765000    
 C   -5.112800      -1.471200      0.6298000    
 C   -5.947700      0.5697000     -0.5965000    
 C   -6.211300     -0.4169000      0.5367000    
 C   -2.092100      0.8146000     -0.2180000    
 C   0.2807000      0.1379000     -0.1248000    
 C    1.237100      -1.003900     -0.2046000    
 C   0.7428000       1.382200      5.0099999E-02
 C    2.681500     -0.7178000     -8.6599998E-02
 C    3.136400      0.5885000      9.5600002E-02
 C    2.178900       1.704200      0.1715000    
 C    3.601800      -1.770700     -0.1584000    
 C    4.507700      0.8455000      0.2071000    
 C    4.968600      -1.512200     -4.7499999E-02
 C    5.420600     -0.2068000      0.1352000    
 H   -3.452500     -0.4140000      -1.333600    
 H   -3.658100     -0.3162000       1.716900    
 H   -2.985100      -1.637600      0.7690000    
 H   -4.395500       1.862700      -1.340500    
 H   -4.541800       1.849100      0.4152000    
 H   -5.297600      -2.119600       1.493700    
 H   -5.142900      -2.110000     -0.2616000    
 H   -6.026100      4.9699999E-02  -1.559100    
 H   -6.716800       1.350300     -0.5918000    
 H   -7.179800     -0.9058000      0.3824000    
 H   -6.275800      0.1277000       1.486800    
 H   -2.070200       1.368700      0.7291000    
 H   -1.939600       1.532700      -1.033500    
 H   -1.256000      -1.143000     -0.4501000    
 H   8.0399998E-02   2.239900      0.1136000    
 H    3.275600      -2.797600     -0.3001000    
 H    4.883200       1.855200      0.3495000    
 H    5.681200      -2.330100     -0.1034000    
 H    6.485100     -8.3999997E-03  0.2214000    


%chk=000032141-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000032141

0 1
O 0.758823 -2.115284 -0.546516
O 2.675863 2.943118 0.459430
N -0.997257 -0.109096 -0.361730
C -3.477719 0.129293 -0.395372
C -3.740390 -0.815752 0.807505
C -4.614813 1.176337 -0.517106
C -5.128327 -1.492300 0.708631
C -6.006317 0.507101 -0.611650
C -6.258072 -0.443186 0.583168
C -2.111431 0.841047 -0.293053
C 0.317224 0.222483 -0.197366
C 1.249888 -0.962861 -0.309670
C 0.808200 1.502164 0.053422
C 2.700759 -0.719364 -0.133833
C 3.179332 0.597810 0.128553
C 2.226031 1.764966 0.228005
C 3.610919 -1.803052 -0.224612
C 4.564905 0.812297 0.297045
C 4.991969 -1.579100 -0.054562
C 5.468476 -0.269713 0.206546
H -3.479635 -0.482723 -1.325372
H -3.687572 -0.220336 1.743591
H -2.950224 -1.588803 0.881900
H -4.441543 1.820330 -1.402207
H -4.589214 1.839226 0.373795
H -5.297366 -2.134631 1.594046
H -5.148359 -2.158953 -0.178461
H -6.070973 -0.070083 -1.557298
H -6.794354 1.283215 -0.657289
H -7.237438 -0.946795 0.470522
H -6.308402 0.151847 1.518586
H -2.055155 1.403938 0.663736
H -2.012739 1.588281 -1.110274
H -1.176417 -1.103059 -0.550945
H 0.141826 2.366565 0.127672
H 3.214478 -2.803264 -0.426725
H 4.904654 1.833389 0.497158
H 5.696149 -2.414871 -0.123744
H 6.542119 -0.096483 0.338577


