%chk=000022187.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022187

0 1
 O  -0.7423000      -2.320500     -0.3056000    
 N   -3.124100     -0.8451000     -3.3199999E-02
 C   -1.837000     -0.1921000      0.2407000    
 C  -0.7184000     -0.9151000     -0.5516000    
 C   -1.945000       1.311100     -8.5299999E-02
 C   0.6594000     -0.3513000     -0.2563000    
 C   -3.070100       2.010000      0.6708000    
 C    1.139400      0.6882000      -1.030200    
 C    1.398600     -0.8923000      0.7785000    
 C    2.405900       1.206100     -0.7590000    
 C    2.664900     -0.3742000       1.049900    
 C    3.168600      0.6750000      0.2812000    
 H   -1.641300     -0.3151000       1.313700    
 H  -0.9082000     -0.8052000      -1.628100    
 H   -2.087000       1.463100      -1.162300    
 H   -1.015000       1.817100      0.1937000    
 H   -3.002300       3.092600      0.5192000    
 H   -4.056500       1.696000      0.3166000    
 H   -3.003900       1.816300       1.746100    
 H   -3.415900     -0.6467000     -0.9894000    
 H   -3.848900     -0.4703000      0.5755000    
 H   0.5565000       1.106200      -1.845600    
 H    1.019100      -1.701200       1.395300    
 H   -1.644700      -2.632600     -0.4897000    
 H    2.798500       2.022400      -1.358200    
 H    3.257800     -0.7859000       1.861400    
 H    4.154400       1.078700      0.4927000    


%chk=000022187-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000022187

0 1
O -0.821718 -2.238394 -0.543442
N -3.035989 -1.012408 0.087128
C -1.840416 -0.122161 0.155059
C -0.718295 -0.796963 -0.731264
C -2.115296 1.342017 -0.255197
C 0.676783 -0.319386 -0.354115
C -3.095455 2.073243 0.686543
C 1.300531 0.741032 -1.056485
C 1.360285 -0.918715 0.733511
C 2.575595 1.212376 -0.666957
C 2.635096 -0.452528 1.122391
C 3.245589 0.619252 0.427800
H -1.485381 -0.149863 1.204086
H -0.921709 -0.531099 -1.795529
H -2.511567 1.352065 -1.293263
H -1.152212 1.886441 -0.282551
H -3.259594 3.115316 0.357590
H -4.081522 1.572332 0.714964
H -2.701676 2.105201 1.720019
H -3.642030 -0.824991 -0.721425
H -3.577440 -1.067983 0.954525
H 0.794911 1.190488 -1.921166
H 0.893881 -1.771948 1.237037
H -1.803271 -2.349485 -0.304517
H 3.048199 2.031421 -1.221367
H 3.158509 -0.928700 1.959772
H 4.236693 0.978641 0.727654


