%chk=000017034.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017034

1 1
 O   0.8766000      0.1238000     -0.4356000    
 O  -0.2415000       1.790900      0.6835000    
 N    4.571800      0.3294000      4.3200001E-02
 C    3.253100     -0.2080000     -0.4940000    
 C    4.771400       1.758900     -0.4394000    
 C    5.715700     -0.5399000     -0.4587000    
 C    4.546900      0.3066000       1.564700    
 C    2.114200      0.6423000      3.3399999E-02
 C    6.083500       2.287400      9.7599998E-02
 C    5.511700      -1.959400      2.4100000E-02
 C   -1.528900      0.1513000     -0.6312000    
 C  -0.2517000      0.7977000     -3.4899998E-02
 C   -1.700000      -1.332300     -0.2197000    
 C   -2.764700      0.9642000     -0.1695000    
 C   -1.302500      0.2286000      -2.170600    
 C   -2.315300      -2.174500      -1.103400    
 C   -3.045100      0.9970000       1.167900    
 C   -1.225600      -1.715900       1.003600    
 C   -3.503800       1.602700      -1.125600    
 C   -2.469100      -3.510500     -0.7332000    
 C   -4.157300       1.728900       1.583700    
 C   -1.379400      -3.052100       1.373800    
 C   -4.616100       2.334600     -0.7096000    
 C   -2.001200      -3.949300      0.5053000    
 C   -4.942700       2.397700      0.6450000    
 H    3.099200      -1.236900     -0.1572000    
 H    3.291300     -0.2021000      -1.589700    
 H    3.973800       2.395400     -5.0999999E-02
 H    4.750000       1.761800      -1.534500    
 H    6.660200     -0.1722000     -5.0099999E-02
 H    5.738900     -0.4838000      -1.552400    
 H    4.006100     -0.5804000       1.910000    
 H    5.571300      0.2775000       1.949100    
 H    4.044700       1.205100       1.937400    
 H    2.170400       1.670100     -0.3321000    
 H    2.074500      0.6472000       1.126500    
 H    6.152600       3.353400     -0.1530000    
 H    6.184500       2.229100       1.183700    
 H    6.956300       1.826400     -0.3724000    
 H    4.687500      -2.470300     -0.4804000    
 H    5.391100      -2.058000       1.105200    
 H    6.407000      -2.540100     -0.2315000    
 H   -1.010700       1.243700      -2.473000    
 H  -0.4812000     -0.4276000      -2.489000    
 H   -2.169200     -4.7200002E-02  -2.779700    
 H   -2.724800      -1.874700      -2.058800    
 H   -2.444500      0.5072000       1.923700    
 H  -0.7354000      -1.042900       1.697900    
 H   -3.296300       1.603200      -2.186700    
 H   -2.960300      -4.208100      -1.405600    
 H   -4.409100       1.782400       2.638900    
 H   -1.014700      -3.394200       2.337900    
 H   -5.226600       2.858500      -1.439400    
 H   -2.122300      -4.989100      0.7943000    
 H   -5.807600       2.969300      0.9690000    


%chk=000017034-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017034

1 1
O 0.835354 0.567897 -0.738188
O -0.286052 1.796710 0.876971
N 4.539646 0.251561 -0.071237
C 3.142162 0.136076 -0.719335
C 5.032017 1.723785 -0.197171
C 5.520381 -0.677955 -0.844055
C 4.479181 -0.160883 1.399409
C 2.082085 1.091474 -0.149776
C 6.444914 1.995407 0.329851
C 5.129702 -2.159716 -0.881021
C -1.583706 0.211498 -0.588460
C -0.357033 0.983935 -0.063453
C -1.469665 -1.153755 0.156741
C -2.897580 0.954962 -0.242714
C -1.516890 0.065867 -2.136761
C -1.310606 -2.382209 -0.528154
C -4.068855 0.222302 0.071954
C -1.525424 -1.164575 1.577061
C -2.992250 2.363357 -0.377937
C -1.216236 -3.598290 0.189497
C -5.303816 0.882510 0.258654
C -1.425357 -2.375562 2.293130
C -4.224267 3.024808 -0.186646
C -1.269997 -3.600545 1.601154
C -5.387182 2.286836 0.131993
H 2.793019 -0.896206 -0.564200
H 3.275412 0.304741 -1.801500
H 4.299303 2.334297 0.355610
H 4.953259 1.974465 -1.269977
H 6.499913 -0.554736 -0.355571
H 5.585764 -0.260766 -1.864568
H 3.892214 -1.085656 1.492407
H 5.499516 -0.329612 1.772548
H 4.001392 0.636948 1.986214
H 2.218804 2.141296 -0.462978
H 2.007192 1.060905 0.953106
H 6.622300 3.082898 0.254990
H 6.565299 1.727552 1.392804
H 7.235216 1.504329 -0.259976
H 4.201338 -2.354213 -1.441586
H 5.046096 -2.607425 0.123389
H 5.937682 -2.701257 -1.404124
H -1.571997 1.060631 -2.610064
H -0.591566 -0.429020 -2.472945
H -2.388656 -0.513275 -2.485586
H -1.277667 -2.407691 -1.621227
H -4.021728 -0.866832 0.176417
H -1.669342 -0.222153 2.118651
H -2.103277 2.957481 -0.617823
H -1.114101 -4.542763 -0.356499
H -6.198481 0.299227 0.502086
H -1.484080 -2.366396 3.387011
H -4.276786 4.114540 -0.285253
H -1.206291 -4.543641 2.154732
H -6.343572 2.799639 0.279905


