%chk=000103817.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103817

0 1
 O   0.2140000      0.3086000       1.226100    
 N   -2.187800     -0.3351000      5.7100002E-02
 N    1.146100      0.6456000     -0.8742000    
 C   -2.632200       1.063400      0.2957000    
 C   -3.228200      -1.367400     -0.1775000    
 C   -4.070600       1.328800     -0.2051000    
 C   -4.530000      -1.037900      0.5902000    
 C   -5.111500      0.3320000      0.2803000    
 C  -0.9645000     -0.4985000     -0.7220000    
 C   -1.744300       2.156100     -0.3601000    
 C   -2.547400       1.302200       1.821300    
 C   -2.733200      -2.721300      0.3944000    
 C   -3.544200      -1.580900      -1.675300    
 C   0.1709000      0.1942000      3.1999999E-03
 C    2.351500       1.316900     -0.4429000    
 C    3.443300      0.3270000     -9.8700002E-02
 C    2.791300       2.333200      -1.494700    
 C    3.539500     -0.8503000     -0.8201000    
 C    4.322200      0.6209000      0.9294000    
 C    4.545900      -1.762700     -0.5032000    
 C    5.328700     -0.2915000       1.246200    
 C    5.440500      -1.483300      0.5298000    
 H   -4.072300       1.330500      -1.302900    
 H   -4.402000       2.336600      7.9599999E-02
 H   -4.343400      -1.100700       1.670600    
 H   -5.297800      -1.798500      0.3942000    
 H   -5.608000      0.7179000       1.179200    
 H   -5.897000      0.2415000     -0.4801000    
 H  -0.6514000      -1.544600     -0.7977000    
 H   -1.081500     -0.1272000      -1.745800    
 H  -0.7976000       2.346800      0.1489000    
 H   -1.575000       1.982000      -1.427500    
 H   -2.261500       3.125000     -0.3081000    
 H   -3.033000       2.251000       2.082800    
 H   -3.054900      0.5243000       2.399100    
 H   -1.528400       1.372200       2.204200    
 H   -1.893500      -3.138300     -0.1702000    
 H   -2.416800      -2.618200       1.439300    
 H   -3.531800      -3.472700      0.3672000    
 H   -3.845600     -0.6584000      -2.177700    
 H   -2.682300      -1.982600      -2.219900    
 H   -4.361500      -2.301000      -1.800900    
 H    1.043500      0.4469000      -1.865600    
 H    2.090500       1.869600      0.4696000    
 H    3.045000       1.844000      -2.442300    
 H    1.990200       3.052300      -1.698700    
 H    3.672700       2.891300      -1.161100    
 H    2.868000      -1.086600      -1.639800    
 H    4.244500       1.546900       1.491400    
 H    4.635700      -2.688900      -1.063300    
 H    6.025800     -7.3799998E-02   2.050000    
 H    6.224800      -2.193100      0.7758000    


%chk=000103817-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000103817

0 1
O 0.085339 0.103481 1.496503
N -2.372022 -0.163688 -0.258699
N 1.236946 0.545721 -0.475953
C -2.908808 1.228179 -0.399527
C -3.197671 -1.270446 0.333267
C -4.439835 1.138820 -0.664416
C -4.345471 -0.654662 1.183416
C -5.226904 0.376500 0.433102
C -1.014940 -0.455963 -0.678301
C -2.276053 1.936225 -1.631766
C -2.626262 2.119214 0.854439
C -2.351206 -2.154902 1.296552
C -3.787685 -2.178685 -0.791515
C 0.130578 0.094193 0.227585
C 2.470895 1.043329 0.182447
C 3.645726 0.096466 -0.112481
C 2.714269 2.520614 -0.186060
C 4.786973 0.487175 -0.854634
C 3.577271 -1.235525 0.378258
C 5.833436 -0.431718 -1.107516
C 4.619745 -2.152389 0.131116
C 5.753973 -1.753542 -0.617194
H -4.576317 0.637961 -1.642611
H -4.840800 2.165220 -0.773055
H -3.883658 -0.185601 2.072095
H -4.975119 -1.483955 1.558657
H -5.645947 1.088304 1.169342
H -6.094075 -0.129340 -0.032535
H -0.876728 -1.553046 -0.696542
H -0.819538 -0.114756 -1.718337
H -1.198390 2.138996 -1.490173
H -2.410776 1.337166 -2.551779
H -2.774806 2.910551 -1.782783
H -2.938338 3.164969 0.665060
H -3.168238 1.755422 1.742574
H -1.551511 2.110416 1.102442
H -1.669113 -2.836906 0.754359
H -1.745442 -1.518916 1.964345
H -3.023713 -2.789834 1.903086
H -4.499474 -1.622279 -1.425894
H -2.977191 -2.555076 -1.444081
H -4.312096 -3.054654 -0.362454
H 1.229375 0.496421 -1.498048
H 2.235251 0.982138 1.262888
H 2.869060 2.656749 -1.273160
H 1.840011 3.124143 0.111668
H 3.602148 2.915453 0.339279
H 4.871991 1.510756 -1.234904
H 2.701434 -1.543960 0.962495
H 6.709994 -0.112988 -1.683253
H 4.553409 -3.173637 0.523101
H 6.565702 -2.463917 -0.810210


