%chk=000068861.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068861

0 1
 O   -4.367600     -6.6100001E-02   1.058700    
 O    5.859000      -1.416000      -1.102400    
 N   -5.521800      -1.884200      -1.771600    
 C   -1.927000      0.2992000      0.8891000    
 C   -1.082900      0.7813000     -0.3105000    
 C   -3.253900     -9.3900003E-02  0.1687000    
 C   0.2862000       1.351500      9.0400003E-02
 C   -2.044400       1.680500      -1.082100    
 C   -1.142200     -0.8327000       1.574300    
 C   -3.425600       1.026000     -0.8918000    
 C    1.066300      0.2824000      0.8806000    
 C   0.2666000     -0.3766000       2.001000    
 C   -2.216100       1.417100       1.932800    
 C    1.032200       1.862700      -1.154800    
 C   -3.263700      -1.472700     -0.5028000    
 C    2.362900     -4.6999999E-03  0.6026000    
 C    2.511100       2.052200     -0.8600000    
 C    3.103000      0.7372000     -0.4273000    
 C    3.212800      -1.028300       1.326200    
 C   -4.525200      -1.695800      -1.207900    
 C    4.249400      0.2946000     -0.9701000    
 C    4.011900      -1.887100      0.3530000    
 C    4.809000      -1.026700     -0.5961000    
 H  -0.8747000     -8.0799997E-02 -0.9636000    
 H   0.1537000       2.213200      0.7565000    
 H   -1.779300       1.744700      -2.142600    
 H   -2.048300       2.700500     -0.6815000    
 H   -1.020700      -1.686600      0.8968000    
 H   -1.690700      -1.203500       2.448500    
 H   -4.148400       1.784100     -0.5657000    
 H   -3.783800      0.6601000      -1.859400    
 H   0.7680000      -1.251900       2.417900    
 H   0.1917000      0.3367000       2.830200    
 H   -1.308900       1.872500       2.337000    
 H   -2.816900       2.232000       1.516400    
 H   -2.771800       1.010200       2.785700    
 H   0.5984000       2.815200      -1.482300    
 H   0.9147000       1.159300      -1.990600    
 H   -3.167500      -2.256600      0.2581000    
 H   -2.432100      -1.592700      -1.204000    
 H    2.648300       2.797600     -6.6399999E-02
 H    3.010200       2.442400      -1.755100    
 H   -5.184200      2.0500001E-02  0.5386000    
 H    3.903400     -0.4925000       1.991900    
 H    2.634700      -1.702100       1.960500    
 H    4.788200      0.8641000      -1.719700    
 H    3.352500      -2.532500     -0.2383000    
 H    4.706000      -2.520900      0.9158000    


%chk=000068861-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068861

0 1
O -4.380697 -0.047833 1.219029
O 6.185154 -1.268526 -0.846602
N -5.623106 -1.939457 -1.720995
C -1.952419 0.311860 0.884439
C -1.120821 0.791123 -0.344502
C -3.324496 -0.037094 0.194915
C 0.279731 1.339702 0.028843
C -2.086834 1.719293 -1.125812
C -1.178582 -0.840960 1.564258
C -3.507236 1.114752 -0.858794
C 1.047532 0.265728 0.822293
C 0.259379 -0.385353 1.956293
C -2.220272 1.449086 1.910235
C 1.040017 1.815119 -1.230337
C -3.313276 -1.450756 -0.483830
C 2.365122 -0.051580 0.544390
C 2.534142 2.035717 -0.920128
C 3.148666 0.739346 -0.427369
C 3.158618 -1.136909 1.272083
C -4.579542 -1.731561 -1.179322
C 4.409135 0.350686 -0.837119
C 4.125942 -1.892475 0.329299
C 5.015061 -0.939886 -0.473568
H -0.926447 -0.102850 -0.979365
H 0.136670 2.221523 0.693654
H -1.847606 1.754169 -2.202828
H -2.021842 2.756207 -0.745263
H -1.083495 -1.702423 0.874229
H -1.711591 -1.194528 2.467523
H -4.184725 1.874251 -0.429377
H -3.978810 0.745435 -1.787269
H 0.801652 -1.247879 2.377383
H 0.182016 0.348606 2.786317
H -1.284541 1.842103 2.341571
H -2.762425 2.296896 1.458449
H -2.848118 1.064232 2.729844
H 0.584800 2.747771 -1.612342
H 0.943766 1.052772 -2.029865
H -3.170018 -2.221525 0.295201
H -2.482451 -1.537935 -1.208205
H 2.627245 2.809771 -0.129344
H 3.076585 2.409511 -1.806669
H -5.260598 -0.170849 0.777420
H 3.756681 -0.660722 2.077260
H 2.495007 -1.867364 1.764536
H 5.001775 0.993938 -1.499323
H 3.546214 -2.498213 -0.397523
H 4.771534 -2.590018 0.890987


