%chk=000019535.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019535

0 1
 O   -3.416400     -0.5327000      -1.181400    
 O    2.711900     -0.6079000     -8.3999997E-03
 O    2.594100       1.589500     -0.7799000    
 O    8.121000      0.1347000      0.7470000    
 N   -4.667600       1.496700      0.3448000    
 C   -4.141900     -0.9019000     -7.8999996E-03
 C   -5.221700      0.1532000      0.2544000    
 C   -4.660100      -2.336700     -0.1897000    
 C   -5.368200      -2.911000       1.041600    
 C   -3.758100       1.605500       1.487500    
 C   -5.737200       2.491500      0.4530000    
 C   -5.845800      -4.333900      0.7908000    
 C   -3.120700       2.983000       1.552900    
 C   -6.694800       2.398200     -0.7228000    
 C   -2.082200     -0.2794000      -1.020800    
 C   -1.243300      -1.277000     -0.5330000    
 C   -1.573100      0.9746000      -1.345000    
 C   0.1174000      -1.018000     -0.3680000    
 C  -0.2124000       1.233400      -1.180000    
 C   0.6327000      0.2372000     -0.6916000    
 C    2.051400      0.5070000     -0.5192000    
 C    4.083400     -0.4208000      0.1838000    
 C    4.521800      5.7700001E-02   1.398200    
 C    4.942300     -0.7208000     -0.8500000    
 C    5.890600      0.2462000       1.589000    
 C    6.311300     -0.5324000     -0.6593000    
 C    6.785500     -4.8999999E-02  0.5603000    
 C    8.979900     -0.1870000     -0.3460000    
 H   -3.479400     -0.9530000      0.8654000    
 H   -5.792900     -9.4300002E-02   1.157000    
 H   -5.904700      7.3600002E-02 -0.5974000    
 H   -5.342100      -2.360300      -1.050000    
 H   -3.827300      -2.994200     -0.4678000    
 H   -6.235200      -2.296600       1.304900    
 H   -4.686500      -2.902600       1.899500    
 H   -4.271700       1.394500       2.434200    
 H   -2.924500      0.9041000       1.415700    
 H   -6.296500       2.392400       1.391800    
 H   -5.324100       3.504800      0.4181000    
 H   -6.553900      -4.368700     -4.3299999E-02
 H   -6.348400      -4.726900       1.680100    
 H   -5.004900      -4.994200      0.5563000    
 H   -2.282100       2.965600       2.258300    
 H   -3.814400       3.748100       1.915100    
 H   -2.722100       3.295400      0.5819000    
 H   -7.315300       3.301100     -0.7596000    
 H   -7.386600       1.554700     -0.6355000    
 H   -6.164000       2.331900      -1.678800    
 H   -1.623300      -2.263100     -0.2852000    
 H   -2.226800       1.753300      -1.727400    
 H   0.7359000      -1.825600      1.2800000E-02
 H   0.1684000       2.218200      -1.437900    
 H    3.825300      0.2869000       2.198500    
 H    4.571800      -1.097200      -1.798400    
 H    6.253900      0.6231000       2.541100    
 H    6.950000     -0.7816000      -1.499800    
 H    8.931600      -1.252400     -0.5957000    
 H    8.783600      0.4520000      -1.213600    
 H    10.00550      1.9200001E-02 -2.2700001E-02


%chk=000019535-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000019535

0 1
O -3.603185 -1.273143 -1.390589
O 2.600062 0.089197 -0.517987
O 2.729904 -0.951576 -2.629277
O 7.924941 1.394174 0.796711
N -4.157759 1.042094 1.096089
C -4.417526 -1.175418 -0.136791
C -4.925862 0.275840 0.077725
C -5.552588 -2.193483 -0.347642
C -6.344197 -2.520814 0.940270
C -4.567153 0.664424 2.480676
C -4.228724 2.515303 0.864581
C -7.448812 -3.570002 0.688912
C -3.522540 1.030283 3.551529
C -3.392847 2.987236 -0.339804
C -2.226275 -1.036680 -1.366547
C -1.541945 -0.379376 -0.310231
C -1.515341 -1.499565 -2.506884
C -0.146039 -0.217250 -0.392406
C -0.126633 -1.324766 -2.578714
C 0.579821 -0.689881 -1.517876
C 2.049239 -0.553296 -1.651281
C 3.987316 0.357171 -0.323252
C 4.257780 1.049768 0.882642
C 5.039715 -0.008141 -1.192327
C 5.578235 1.379516 1.224936
C 6.369869 0.326143 -0.843125
C 6.643578 1.017583 0.360787
C 9.056762 1.044692 -0.063758
H -3.776089 -1.487249 0.713027
H -6.012226 0.245059 0.339756
H -4.851723 0.789986 -0.895663
H -6.242822 -1.812615 -1.127023
H -5.105978 -3.124001 -0.745909
H -6.802454 -1.599930 1.353989
H -5.645471 -2.900076 1.714311
H -5.557404 1.118214 2.742755
H -4.715844 -0.431634 2.498440
H -5.290878 2.849543 0.744429
H -3.845061 3.013935 1.772165
H -8.176116 -3.207920 -0.061791
H -8.004790 -3.799643 1.615963
H -7.017749 -4.514840 0.308766
H -3.847744 0.661426 4.541805
H -3.372653 2.121046 3.638267
H -2.548132 0.570274 3.309681
H -3.451916 4.087423 -0.433027
H -3.745477 2.554843 -1.293273
H -2.334917 2.700850 -0.212943
H -2.112641 0.048599 0.523260
H -2.071195 -1.997561 -3.306848
H 0.393622 0.287846 0.413283
H 0.439864 -1.681282 -3.445104
H 3.423620 1.319631 1.537095
H 4.827962 -0.538119 -2.120909
H 5.808224 1.913797 2.151280
H 7.175380 0.037881 -1.524995
H 9.143006 -0.052239 -0.191460
H 8.971680 1.527090 -1.057239
H 9.945229 1.427733 0.459445


