%chk=000004910.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004910

0 1
 O    1.041800     -0.3255000     -0.2471000    
 O  -0.1843000      -2.114600      0.5112000    
 N    4.686000     -0.8361000     -3.0000000E-03
 C   -1.351600     -0.1504000     -0.4287000    
 C   -1.497400     -0.5456000      -1.950900    
 C   -2.615900     -0.4761000      0.4108000    
 C   -1.076700       1.372500     -0.2670000    
 C   -1.804300      -2.029600      -2.226700    
 C  -0.1246000     -0.9879000      3.2099999E-02
 C   -2.487800     -0.8507000       1.748400    
 C   -1.074000       2.203800      -1.387200    
 C   -3.880500     -0.3947000     -0.1724000    
 C  -0.8321000       1.906600      0.9983000    
 C   -1.976000      -2.287100      -3.717400    
 C    2.247000      -1.034600      5.7200000E-02
 C    3.434800     -0.1603000     -0.3122000    
 C   -3.624100      -1.143500       2.502500    
 C  -0.8273000       3.569000      -1.242000    
 C   -5.016700     -0.6875000      0.5818000    
 C  -0.5854000       3.271800       1.143300    
 C    5.790800     -0.2589000     -0.7726000    
 C    4.975400     -0.7600000       1.431100    
 C   -4.888500      -1.062000       1.919100    
 C  -0.5829000       4.102900      2.3300000E-02
 C    6.010400       1.199700     -0.4084000    
 C    6.244100      -1.521300       1.776300    
 H  -0.5649000     -0.3050000      -2.482300    
 H   -2.288700      3.9999999E-02  -2.434700    
 H   -2.713000      -2.351700      -1.710300    
 H  -0.9865000      -2.662700      -1.868200    
 H   -1.525200     -0.9080000       2.246800    
 H   -1.250600       1.856100      -2.397600    
 H   -4.024400     -8.5400000E-02  -1.201900    
 H  -0.7987000       1.286700       1.887500    
 H   -1.070200      -2.016900      -4.269500    
 H   -2.179800      -3.347300      -3.897500    
 H   -2.812100      -1.707500      -4.121600    
 H    2.269300      -1.967900     -0.5188000    
 H    2.236200      -1.273900       1.125100    
 H    3.354000      4.7899999E-02  -1.388000    
 H    3.335000      0.8125000      0.1871000    
 H   -3.525200      -1.430500       3.545400    
 H  -0.8234000       4.217000      -2.113700    
 H   -6.001800     -0.6187000      0.1296000    
 H  -0.3885000       3.686800       2.127500    
 H    5.560600     -0.3303000      -1.843700    
 H    6.717100     -0.8313000     -0.6568000    
 H    4.172600      -1.255700       1.988500    
 H    5.017900      0.2613000       1.825500    
 H   -5.773400      -1.287700       2.507100    
 H  -0.3887000       5.165500      0.1360000    
 H    5.127300       1.827100     -0.5569000    
 H    6.382500       1.341600      0.6100000    
 H    6.784700       1.609300      -1.068600    
 H    6.250700      -2.521700       1.329800    
 H    7.150300     -0.9905000       1.469700    
 H    6.309400      -1.650700       2.862600    


%chk=000004910-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004910

0 1
O 0.996150 -0.532733 -0.221903
O -0.113100 -1.021996 1.752226
N 4.716914 -0.837888 0.103441
C -1.376103 0.008099 -0.153168
C -1.303775 -0.270236 -1.692392
C -2.715598 -0.551534 0.386822
C -1.257297 1.530034 0.175064
C -1.368895 -1.760661 -2.090451
C -0.147440 -0.599552 0.573437
C -2.840917 -1.833686 0.978410
C -1.001377 2.513977 -0.810338
C -3.895885 0.208105 0.172908
C -1.398515 1.943528 1.527170
C -1.262345 -1.946715 -3.619569
C 2.275986 -0.950246 0.426695
C 3.409379 -0.490262 -0.500955
C -4.108301 -2.334822 1.353601
C -0.897788 3.880000 -0.455646
C -5.162776 -0.292275 0.541713
C -1.290049 3.303251 1.882686
C 5.721718 -1.351844 -0.859680
C 5.209245 0.185575 1.060893
C -5.275863 -1.569814 1.137292
C -1.040012 4.281160 0.890618
C 6.274849 -0.326867 -1.888687
C 6.310413 -0.340553 1.999969
H -0.364391 0.154924 -2.088934
H -2.146851 0.267288 -2.170542
H -2.312584 -2.209382 -1.728434
H -0.542313 -2.310426 -1.597977
H -1.950771 -2.437325 1.172910
H -0.882616 2.230479 -1.859806
H -3.819955 1.205118 -0.276850
H -1.594102 1.189896 2.298550
H -0.307262 -1.543204 -4.006332
H -1.314660 -3.015448 -3.897148
H -2.085195 -1.422930 -4.142378
H 2.278698 -2.047371 0.546410
H 2.332734 -0.490156 1.428984
H 3.305954 -1.008696 -1.471646
H 3.296509 0.599909 -0.703821
H -4.180022 -3.325005 1.818071
H -0.705439 4.627665 -1.233748
H -6.058237 0.315586 0.368645
H -1.401816 3.600740 2.931446
H 5.256682 -2.197086 -1.402448
H 6.562763 -1.781901 -0.285240
H 4.346187 0.501734 1.676513
H 5.571912 1.107026 0.539645
H -6.256950 -1.959968 1.430869
H -0.958461 5.339125 1.164422
H 5.462993 0.103907 -2.503527
H 6.805457 0.505418 -1.391382
H 6.990519 -0.821574 -2.571607
H 5.967376 -1.256340 2.512752
H 7.243374 -0.576740 1.457181
H 6.554551 0.420987 2.763167


