%chk=000013774.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013774

0 1
 O    3.169300       3.033800      0.6737000    
 O    1.019600       3.038300      0.2288000    
 O    4.768600      -2.885400     -0.2204000    
 O    5.734300      -1.003500      0.3667000    
 O   -6.421700     -0.2429000     -0.4229000    
 O   -5.738600      -1.690600       1.079300    
 N  -0.2193000      0.9911000     -0.4506000    
 N    2.117600       2.443100      0.3331000    
 N    4.719000      -1.655500      2.2900000E-02
 N   -5.507900     -0.7755000      0.2523000    
 C    1.026500      0.3458000     -0.3269000    
 C    2.172400       1.048700      5.4800000E-02
 C   -1.546400      0.5477000     -0.2744000    
 C    1.111200      -1.023400     -0.5916000    
 C    3.394800      0.3865000      0.1706000    
 C    3.475100     -0.9805000     -9.4700001E-02
 C    2.333300      -1.685400     -0.4758000    
 C   -2.578600       1.124800      -1.014100    
 C   -1.826800     -0.4678000      0.6398000    
 C   -4.171600     -0.3293000      7.4600004E-02
 C   -3.891200      0.6864000     -0.8396000    
 C   -3.139400     -0.9064000      0.8144000    
 H  -0.1580000       1.936400     -0.8167000    
 H   0.2457000      -1.595600     -0.9144000    
 H    4.287500      0.9319000      0.4677000    
 H    2.359600      -2.749700     -0.6955000    
 H   -2.372500       1.916300      -1.730200    
 H   -1.046400     -0.9190000       1.246400    
 H   -4.669800       1.158900      -1.433100    
 H   -3.321500      -1.695900       1.539100    


%chk=000013774-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013774

0 1
O 3.358830 3.137528 0.353344
O 1.138233 3.223774 -0.132433
O 4.805441 -2.941432 -0.105175
O 5.870499 -0.933203 0.140702
O -6.523764 -0.121491 -0.559272
O -5.882308 -1.885928 0.741940
N -0.236129 1.012007 -0.245648
N 2.250048 2.552760 0.075647
N 4.808710 -1.651975 -0.008320
N -5.629052 -0.818125 0.059762
C 0.977228 0.351657 -0.184592
C 2.215145 1.088356 -0.025660
C -1.549835 0.490204 -0.169003
C 1.088865 -1.072105 -0.320329
C 3.462476 0.432246 0.038625
C 3.505154 -0.961313 -0.073075
C 2.321717 -1.720674 -0.270805
C -2.576232 1.214632 -0.840526
C -1.891580 -0.655472 0.604646
C -4.223147 -0.362785 -0.016209
C -3.912554 0.793047 -0.767176
C -3.227275 -1.084431 0.677666
H -0.122120 2.044051 -0.325548
H 0.187872 -1.656229 -0.516856
H 4.379429 1.012215 0.171653
H 2.399726 -2.804075 -0.394235
H -2.313354 2.100163 -1.428940
H -1.130297 -1.177089 1.190196
H -4.712674 1.330948 -1.281809
H -3.514252 -1.953961 1.274730


