%chk=000060178.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060178

0 1
 O  -6.2100001E-02  -1.313100      0.3511000    
 N   -6.111900      0.5609000      0.8650000    
 C    4.715700     -0.2988000     -0.2229000    
 C    3.383400      0.1874000      0.3516000    
 C    5.875000      0.6713000      2.2900000E-02
 C    2.269100     -0.8271000      9.8899998E-02
 C    7.220400      0.1524000     -0.4859000    
 C   0.9301000     -0.3347000      0.6296000    
 C    8.348100       1.118000     -0.1542000    
 C   -5.336900      0.5468000     -0.3895000    
 C   -3.942700      5.5399999E-02 -0.1939000    
 C   -1.343500     -0.8606000      0.1712000    
 C   -3.509200      -1.093900     -0.8543000    
 C   -3.072000      0.7454000      0.6498000    
 C   -2.205200      -1.553800     -0.6711000    
 C   -1.767800      0.2857000      0.8331000    
 C   -5.390500       1.958600      -1.001600    
 H    4.609400     -0.4627000      -1.302400    
 H    4.964000      -1.270800      0.2217000    
 H    3.120800       1.149300     -0.1050000    
 H    3.488100      0.3583000       1.429700    
 H    5.950200      0.8675000       1.099900    
 H    5.649200       1.631300     -0.4577000    
 H    2.516000      -1.787900      0.5674000    
 H    2.179100      -1.031600     -0.9754000    
 H    7.437900     -0.8221000     -3.3599999E-02
 H    7.174200      4.4000000E-03  -1.570800    
 H   0.7062000      0.6208000      0.1374000    
 H   0.9895000     -0.1812000       1.713400    
 H    8.174600       2.096200     -0.6141000    
 H    9.300700      0.7306000     -0.5287000    
 H    8.440100       1.257800      0.9277000    
 H   -5.868700     -0.1213000      -1.078100    
 H   -4.174600      -1.643100      -1.515200    
 H   -3.389900       1.639100       1.179900    
 H   -1.871200      -2.449200      -1.187400    
 H   -1.131300      0.8348000       1.520000    
 H   -4.952000       2.715800     -0.3419000    
 H   -6.426400       2.253600      -1.204800    
 H   -4.843500       1.988200      -1.950800    
 H   -6.079400     -0.3603000       1.299700    
 H   -5.700100       1.215100       1.528700    


%chk=000060178-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060178

0 1
O -0.016047 -0.864562 -0.548987
N -6.126544 0.632984 1.432011
C 4.932945 -0.299121 -0.262127
C 3.558064 0.275246 0.148077
C 6.123361 0.550626 0.236071
C 2.377003 -0.574864 -0.373551
C 7.497657 -0.020310 -0.182376
C 1.021189 0.014145 0.021257
C 8.682582 0.838691 0.309528
C -5.655268 0.323704 0.062370
C -4.148242 0.028918 -0.061518
C -1.360590 -0.509439 -0.347131
C -3.690109 -1.100551 -0.789234
C -3.177154 0.874699 0.526151
C -2.316299 -1.373740 -0.935154
C -1.793621 0.621951 0.390670
C -6.074763 1.483012 -0.873051
H 4.978820 -0.380702 -1.368135
H 5.030194 -1.333004 0.129896
H 3.468291 1.312764 -0.237227
H 3.507871 0.347355 1.254802
H 6.082556 0.630316 1.342745
H 6.024665 1.585699 -0.153628
H 2.448466 -1.606625 0.021117
H 2.424101 -0.649483 -1.477013
H 7.598825 -1.052291 0.211672
H 7.534687 -0.105403 -1.287715
H 0.902626 1.041752 -0.383646
H 0.910731 0.054706 1.125782
H 8.623498 1.865825 -0.097724
H 9.652305 0.407697 -0.000595
H 8.684771 0.916045 1.413319
H -6.196864 -0.584866 -0.270306
H -4.421989 -1.778030 -1.247912
H -3.499735 1.748816 1.106161
H -1.961435 -2.245876 -1.493194
H -1.073003 1.299183 0.858865
H -5.567875 2.423516 -0.580998
H -7.166034 1.639384 -0.813105
H -5.796827 1.265241 -1.918581
H -5.846753 -0.059952 2.134648
H -5.913155 1.589042 1.737162


