%chk=000036763.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036763

0 1
 O  -0.2046000      -1.214400     -0.1471000    
 N    3.259700      6.7699999E-02 -0.2193000    
 C   0.8703000     -0.3145000     -0.5260000    
 C   0.4813000       1.117400     -0.1263000    
 C  -0.9880000      0.9527000     -6.2799998E-02
 C    2.156900     -0.7762000      0.1384000    
 C   -1.302200     -0.3976000     -5.2999999E-02
 C   -2.603800     -0.8448000      6.3900001E-02
 C   -1.978000       1.912500      4.1600000E-02
 C   -3.614400      0.1135000      0.1602000    
 C    4.503700     -0.3621000      0.4237000    
 C   -3.303800       1.483600      0.1474000    
 C   -2.932200      -2.296200      8.3999999E-02
 C    5.655200      0.5583000      7.5300001E-02
 H   0.9675000     -0.3849000      -1.619400    
 H   0.8021000       1.847800     -0.8743000    
 H   0.8650000       1.399100      0.8602000    
 H    2.348000      -1.817000     -0.1540000    
 H    2.011100     -0.7931000       1.226500    
 H   -1.737900       2.970100      4.8500001E-02
 H    3.384100      8.1000000E-02  -1.231000    
 H   -4.655700     -0.1865000      0.2496000    
 H    4.378600     -0.3660000       1.512900    
 H    4.756100      -1.382400      0.1118000    
 H   -4.102600       2.215900      0.2287000    
 H   -2.622600      -2.768900     -0.8539000    
 H   -2.423500      -2.790300      0.9183000    
 H   -4.006900      -2.469000      0.2038000    
 H    5.841400      0.5691000      -1.003900    
 H    5.452000       1.585200      0.3972000    
 H    6.571900      0.2244000      0.5720000    


%chk=000036763-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000036763

0 1
O -0.301732 -1.171713 -0.974273
N 3.240864 -0.048196 -0.309620
C 0.922498 -0.299816 -1.141534
C 0.448442 1.168913 -0.929880
C -0.911191 0.990966 -0.267730
C 1.963812 -0.762433 -0.103559
C -1.284266 -0.368159 -0.353777
C -2.514715 -0.876448 0.114434
C -1.790754 1.915665 0.322595
C -3.384930 0.078520 0.704914
C 4.240237 -0.235191 0.768472
C -3.036699 1.447286 0.813671
C -2.861075 -2.344903 -0.012602
C 5.539773 0.522441 0.447445
H 1.288547 -0.491125 -2.166210
H 0.352796 1.707248 -1.891762
H 1.186850 1.712588 -0.315331
H 2.051080 -1.873561 -0.159948
H 1.588085 -0.517843 0.909119
H -1.524226 2.975746 0.399280
H 3.649367 -0.264974 -1.231065
H -4.353646 -0.264433 1.088558
H 3.802033 0.157478 1.706881
H 4.473851 -1.313890 0.953064
H -3.737795 2.148241 1.279581
H -2.848912 -2.668495 -1.070076
H -2.122965 -2.976523 0.516409
H -3.861012 -2.555824 0.403609
H 6.008040 0.137218 -0.478988
H 5.333409 1.597703 0.305410
H 6.272931 0.407913 1.265916


