%chk=000071028.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071028

0 1
 O    3.991300       1.044500      0.1697000    
 N   -3.793000      0.6987000      0.2225000    
 N  -0.8279000      -1.549300     -0.2397000    
 C   -3.194600     -0.5834000     -0.2228000    
 C  -0.9736000      0.6598000     -2.1000000E-02
 C   -1.702900     -0.5046000     -0.1428000    
 C   -1.651000       1.981200      8.5900001E-02
 C   -3.122400       1.870500     -0.3680000    
 C   0.4031000      0.3095000     -1.2300000E-02
 C   0.4669000      -1.081600     -0.1503000    
 C   -3.765900      -1.701300      0.6460000    
 C    1.606100       1.035200      9.6600004E-02
 C    1.679300      -1.780100     -0.1849000    
 C    2.824700      0.3479000      6.4599998E-02
 C    2.858400      -1.038000     -7.3899999E-02
 C    5.201400      0.2911000      0.1303000    
 H   -3.486600     -0.7598000      -1.265400    
 H   -1.611400       2.316700       1.129500    
 H   -1.134300       2.729300     -0.5253000    
 H   -3.661100       2.778400     -7.5499997E-02
 H   -3.180500       1.809000      -1.462200    
 H   -3.731900      0.7654000       1.239200    
 H   -1.083600      -2.520300     -0.3560000    
 H   -3.472000      -1.591700       1.696700    
 H   -4.860900      -1.714300      0.5995000    
 H   -3.414000      -2.682000      0.3069000    
 H    1.589300       2.116400      0.2043000    
 H    1.706300      -2.859300     -0.2938000    
 H    3.776400      -1.616400     -0.1046000    
 H    5.329700     -0.2163000     -0.8319000    
 H    5.275200     -0.3985000      0.9781000    
 H    6.027800       1.002900      0.2269000    


%chk=000071028-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000071028

0 1
O 4.011532 1.084935 0.167459
N -3.824853 0.727563 0.228211
N -0.861723 -1.623810 -0.237594
C -3.246221 -0.578658 -0.206658
C -0.978809 0.648879 -0.011201
C -1.729270 -0.521380 -0.143510
C -1.619181 2.013220 0.083123
C -3.116673 1.907122 -0.341437
C 0.419843 0.264823 -0.007168
C 0.465557 -1.170745 -0.152930
C -3.856535 -1.718660 0.636930
C 1.631263 0.989607 0.096989
C 1.683680 -1.873238 -0.191277
C 2.851567 0.282556 0.057046
C 2.885094 -1.137639 -0.085098
C 5.305497 0.408413 0.132444
H -3.558445 -0.730806 -1.262863
H -1.547338 2.413112 1.116808
H -1.098016 2.743161 -0.568836
H -3.669114 2.817886 -0.046609
H -3.178453 1.825560 -1.443712
H -3.838402 0.775774 1.259605
H -1.149660 -2.594721 -0.329724
H -3.552066 -1.633480 1.697007
H -4.957521 -1.668545 0.579182
H -3.539962 -2.712271 0.270123
H 1.651395 2.077971 0.207631
H 1.716417 -2.963064 -0.301030
H 3.839042 -1.671746 -0.114910
H 5.462124 -0.124640 -0.826817
H 5.414860 -0.307585 0.971617
H 6.052670 1.210005 0.233497


