%chk=000071148.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071148

0 1
 O    2.467100       1.649100      0.8050000    
 O    4.745600       1.292500     -0.4377000    
 O    6.810900     -0.5149000     -0.7723000    
 N   -2.952600      0.7796000     -0.5035000    
 N   0.9505000     -6.1500002E-02  0.4146000    
 C   -2.772100      0.5973000      0.9485000    
 C   -2.074900       1.927500     -0.7968000    
 C   -2.781800       2.019500       1.519200    
 C   -2.318500       2.903600      0.3593000    
 C   -1.402600     -8.7200001E-02   1.134700    
 C  -0.6316000       1.383900     -0.7954000    
 C  -0.2435000      0.7373000      0.5464000    
 C   -4.344500       1.022500     -0.8746000    
 C   -5.221900     -0.1617000     -0.5665000    
 C    2.224000      0.4710000      0.5574000    
 C   -5.403900      -1.145800      -1.528200    
 C   -5.835900     -0.2529000      0.6750000    
 C    3.351100     -0.4779000      0.3657000    
 C   -6.216600      -2.242900      -1.242900    
 C   -6.648400      -1.350200      0.9602000    
 C   -6.838800      -2.345200      1.2000001E-03
 C    4.559000     -2.1299999E-02 -0.1219000    
 C    3.144800      -1.804400      0.6893000    
 C    5.604600     -0.9286000     -0.2934000    
 C    4.190300      -2.711500      0.5178000    
 C    5.420200      -2.273700      2.6500000E-02
 C    4.442000       1.685600      -1.773800    
 C    7.777600     -8.9800000E-02  0.1863000    
 H   -3.495000     -4.6200000E-02   1.449000    
 H   -2.280900       2.384000      -1.771400    
 H   -3.795300       2.311700       1.817800    
 H   -2.135900       2.128500       2.396500    
 H   -1.427200       3.484200      0.6190000    
 H   -3.111900       3.616000      0.1036000    
 H   -1.434500      -1.078600      0.6613000    
 H   -1.213800     -0.2659000       2.201000    
 H   7.1800001E-02   2.193400      -1.028400    
 H  -0.5269000      0.6480000      -1.605000    
 H  -1.4000000E-02   1.544700       1.253700    
 H   -4.767500       1.916400     -0.3979000    
 H   -4.399600       1.220900      -1.953600    
 H   0.8306000      -1.016900      9.4300002E-02
 H   -4.922500      -1.077600      -2.499600    
 H   -5.719400      0.5250000       1.424100    
 H   -6.364600      -3.017800      -1.989400    
 H   -7.137600      -1.427200       1.926800    
 H   -7.472500      -3.198900      0.2230000    
 H    2.214400      -2.177400       1.105500    
 H    4.049700      -3.757700      0.7740000    
 H    6.230500      -2.986000     -0.1034000    
 H    3.401700       1.454100      -2.023700    
 H    4.587300       2.766400      -1.853700    
 H    5.115000       1.189900      -2.480400    
 H    8.679800      0.2170000     -0.3499000    
 H    7.403100      0.7648000      0.7587000    
 H    8.034300     -0.9116000      0.8622000    


%chk=000071148-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000071148

0 1
O 2.508093 1.588008 0.937824
O 4.995901 0.891241 -0.999403
O 7.028597 -0.983115 -0.829908
N -2.973253 0.845285 -0.376299
N 1.070779 -0.114648 0.267594
C -2.644150 0.515162 1.051417
C -2.036989 1.988715 -0.638472
C -2.542699 1.905954 1.778351
C -2.139126 2.901989 0.637699
C -1.289422 -0.236458 1.050953
C -0.619108 1.392399 -0.812090
C -0.162048 0.664042 0.484384
C -4.405808 1.175404 -0.606252
C -5.306499 -0.053478 -0.516057
C 2.334407 0.392798 0.529559
C -4.880613 -1.301952 -1.037197
C -6.600432 0.043589 0.052591
C 3.462672 -0.593760 0.351358
C -5.733812 -2.426296 -0.996032
C -7.458849 -1.079763 0.092609
C -7.027868 -2.319453 -0.432335
C 4.703682 -0.266798 -0.273825
C 3.308171 -1.877411 0.952134
C 5.787965 -1.205334 -0.209673
C 4.358953 -2.811889 0.964790
C 5.603208 -2.464481 0.394534
C 3.935115 1.691376 -1.631483
C 7.769290 0.244084 -0.464712
H -3.429399 -0.131174 1.478191
H -2.335479 2.516292 -1.561988
H -3.513475 2.182687 2.226075
H -1.801567 1.882561 2.596843
H -1.186793 3.419978 0.848143
H -2.911229 3.679688 0.498542
H -1.405802 -1.141377 0.421899
H -1.025275 -0.562347 2.075035
H 0.111411 2.185675 -1.059055
H -0.646844 0.672199 -1.651998
H 0.106449 1.432065 1.232512
H -4.798271 1.960770 0.085049
H -4.469918 1.599487 -1.628922
H 0.990579 -1.043736 -0.151848
H -3.871808 -1.372071 -1.458441
H -6.938485 1.002038 0.467344
H -5.392815 -3.385462 -1.402919
H -8.457021 -0.988974 0.536216
H -7.690031 -3.192144 -0.399729
H 2.366361 -2.110060 1.461369
H 4.224454 -3.789301 1.438760
H 6.450908 -3.156638 0.394462
H 3.500631 2.397069 -0.905718
H 4.439689 2.222781 -2.453516
H 3.140545 1.037549 -2.039647
H 8.708534 0.185929 -1.035618
H 7.199260 1.145773 -0.739571
H 7.988439 0.248632 0.620668


