%chk=000096551.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096551

0 1
 O  -6.2300000E-02  0.9173000      -1.780100    
 O   -2.646900       1.664600     -0.7763000    
 N   -2.274800       3.432300      0.6405000    
 C   2.8999999E-02  0.5711000     -0.3841000    
 C  -0.5002000       1.821400      0.3749000    
 C  -0.8292000     -0.6655000     -7.8900002E-02
 C    1.510900      0.2575000     -0.1113000    
 C   -1.325400     -0.8187000       1.192300    
 C    2.268000     -0.2477000      -1.137600    
 C   -1.062600      -1.564400      -1.090500    
 C    2.005400      0.4974000       1.145500    
 C   -1.913500       2.262100      5.1000002E-03
 C   -2.104500      -1.942100       1.469700    
 C    3.611100     -0.5323000     -0.8903000    
 C   -1.841700      -2.687600     -0.8134000    
 C    3.348300      0.2130000       1.392800    
 C   -2.362700      -2.876400      0.4668000    
 C    4.151100     -0.3020000      0.3749000    
 H  -0.4595000       1.738300       1.465200    
 H   0.1478000       2.672400      0.1146000    
 H   -1.125200     -0.1353000       2.007800    
 H    1.871600     -0.4515000      -2.126600    
 H  -0.6590000      -1.446900      -2.090600    
 H    1.407300      0.8771000       1.964500    
 H  -0.9989000      0.9159000      -2.041300    
 H   -2.504500      -2.093300       2.468200    
 H    4.235400     -0.9369000      -1.681500    
 H   -2.040200      -3.417100      -1.593200    
 H    3.768300      0.3874000       2.379200    
 H   -2.967300      -3.752200      0.6832000    
 H    5.196300     -0.5255000      0.5681000    
 H   -1.654200       3.916600       1.281200    
 H   -3.187100       3.848900      0.4866000    


%chk=000096551-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096551

0 1
O -0.092405 0.599623 -1.997526
O -2.273166 2.098235 -1.403332
N -2.382918 3.121586 0.665248
C 0.029016 0.496937 -0.535819
C -0.310351 1.902902 0.071245
C -0.899507 -0.620926 -0.009688
C 1.511892 0.190980 -0.231754
C -1.522189 -0.578728 1.262743
C 2.502594 0.484448 -1.200474
C -1.105170 -1.760642 -0.828470
C 1.909476 -0.325547 1.026730
C -1.727157 2.366559 -0.281709
C -2.338444 -1.645757 1.704908
C 3.869101 0.266516 -0.913009
C -1.915548 -2.828014 -0.388478
C 3.276031 -0.537035 1.315765
C -2.537645 -2.775625 0.881619
C 4.262551 -0.239609 0.347185
H -0.138228 1.920315 1.162003
H 0.403310 2.617307 -0.381735
H -1.383337 0.285045 1.923185
H 2.180885 0.860351 -2.175485
H -0.630794 -1.783756 -1.814384
H 1.152706 -0.591264 1.773490
H -0.993302 1.019514 -2.165437
H -2.817297 -1.592715 2.689551
H 4.625895 0.489095 -1.674150
H -2.065558 -3.699633 -1.035750
H 3.569210 -0.943269 2.290686
H -3.170549 -3.602758 1.222483
H 5.322412 -0.409044 0.569077
H -1.964568 3.338976 1.567690
H -3.316150 3.473835 0.448991


