%chk=000051840.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051840

0 1
 O   2.2800000E-02  -3.232600     -0.1553000    
 O   0.9575000      -2.178700      -1.924700    
 N  -0.5304000      8.3800003E-02 -0.6246000    
 C  -0.7073000       1.275800      0.1962000    
 C   -1.815900     -0.5761000     -0.8592000    
 C   0.4082000     -0.8438000      9.3999999E-03
 C   -1.639200       2.266100     -0.5001000    
 C   -2.448700     -0.9921000      0.4676000    
 C    1.772100     -0.2210000      0.2105000    
 C   -1.855600       3.515700      0.3543000    
 C   -3.804000      -1.665000      0.2465000    
 C   0.5072000      -2.134200     -0.7840000    
 C    2.514200     -0.5646000       1.327600    
 C    2.249500      0.6789000     -0.7270000    
 C   -2.753800       4.522000     -0.3474000    
 C   -4.424200      -2.113900       1.560000    
 C    3.771900      9.3000000E-03   1.513000    
 C    3.507300       1.252700     -0.5414000    
 C    4.268400      0.9179000      0.5786000    
 H   -1.045300       1.066200       1.217200    
 H   0.2353000       1.816500      0.3311000    
 H   -1.699600      -1.454500      -1.505600    
 H   -2.498800      4.6399999E-02  -1.445300    
 H   6.4000003E-02  -1.104300       1.018100    
 H   -2.635900       1.850400     -0.6721000    
 H   -1.225000       2.550300      -1.475700    
 H   -1.835600      -1.703900       1.025900    
 H   -2.640100     -0.1365000       1.121600    
 H  -0.8916000       3.989800      0.5726000    
 H   -2.306000       3.238300       1.314500    
 H   -3.684900      -2.536200     -0.4084000    
 H   -4.487400     -0.9710000     -0.2566000    
 H    2.139700      -1.273200       2.060500    
 H    1.692500      0.9404000      -1.621800    
 H   -3.740300       4.093400     -0.5510000    
 H   -2.315700       4.843500      -1.297700    
 H   -2.891900       5.408200      0.2798000    
 H   -4.585500      -1.263000       2.229700    
 H   -3.781600      -2.837500       2.071700    
 H   -5.392600      -2.590300       1.377900    
 H    4.365100     -0.2522000       2.384400    
 H    3.896900       1.955800      -1.271900    
 H    5.248400       1.363500      0.7222000    
 H   9.0099998E-02  -4.035000     -0.7155000    


%chk=000051840-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000051840

0 1
O 0.725685 -3.224106 0.274439
O 0.607273 -2.255260 -1.831116
N -0.640980 0.047508 -0.366483
C -0.799215 1.299255 0.425249
C -1.922839 -0.638434 -0.694388
C 0.395725 -0.837254 0.225898
C -1.648330 2.372867 -0.285258
C -2.742344 -1.213448 0.494845
C 1.781462 -0.166977 0.241147
C -1.572156 3.737536 0.438507
C -4.034819 -1.909299 0.009065
C 0.561782 -2.128496 -0.590969
C 2.586971 -0.204399 1.403134
C 2.269435 0.463806 -0.930487
C -2.457170 4.814360 -0.225170
C -4.888481 -2.471520 1.166091
C 3.868966 0.392600 1.401165
C 3.547683 1.061441 -0.931341
C 4.351781 1.027467 0.233875
H -1.228973 1.101128 1.440478
H 0.212436 1.713141 0.589782
H -1.700593 -1.450135 -1.410883
H -2.551237 0.083406 -1.246971
H 0.156796 -1.155080 1.268067
H -2.710710 2.062004 -0.343300
H -1.285367 2.478586 -1.326747
H -2.130962 -1.942948 1.064280
H -3.013714 -0.403096 1.201339
H -0.518502 4.082473 0.456608
H -1.876494 3.609907 1.497948
H -3.768086 -2.729827 -0.688130
H -4.638480 -1.187521 -0.579222
H 2.212325 -0.699081 2.307619
H 1.631334 0.481999 -1.820429
H -3.521009 4.510003 -0.224244
H -2.157383 4.980154 -1.277057
H -2.382176 5.781964 0.304244
H -5.193820 -1.666012 1.860504
H -4.320574 -3.219619 1.750740
H -5.806335 -2.961022 0.791449
H 4.485987 0.364055 2.306313
H 3.920841 1.549091 -1.839071
H 5.344999 1.490775 0.231182
H 0.923469 -4.036694 -0.267099


