%chk=000176882.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176882

0 1
 O  -0.4863000     -0.4128000       1.876200    
 N    3.181000      -1.101400     -0.1520000    
 C  -0.5388000     -0.2196000      0.4497000    
 C   0.7300000     -0.9381000     -0.1056000    
 C   -1.867500     -0.8308000     -2.5000000E-02
 C  -0.4985000       1.279400      0.1180000    
 C    2.056300     -0.3756000      0.4308000    
 C   -3.036000     -0.3327000      0.4949000    
 C  -0.6000000       1.660300      -1.197500    
 C   -1.824900      -1.846700     -0.9466000    
 C  -0.3623000       2.173800       1.151200    
 C  -0.5369000      -1.788900       2.199000    
 C    4.446800     -0.5571000      0.3168000    
 C   -4.241300     -0.8871000      6.4599998E-02
 C  -0.5632000       3.021600      -1.498900    
 C   -3.030400      -2.401100      -1.377000    
 C  -0.3255000       3.535200      0.8497000    
 C   -4.238700      -1.921300     -0.8714000    
 C  -0.4260000       3.959200     -0.4753000    
 C    5.613700      -1.293000     -0.2665000    
 C    6.548600     -0.7232000      -1.035200    
 H   0.7201000      -2.020300      7.1400002E-02
 H   0.7580000     -0.8278000      -1.199900    
 H    2.086300     -0.4677000       1.522100    
 H    2.142000      0.6872000      0.1793000    
 H   -3.053100      0.4668000       1.228600    
 H  -0.7049000      0.9439000      -2.005800    
 H  -0.9193000      -2.252000      -1.378400    
 H  -0.2783000       1.881600       2.192000    
 H    3.134600      -1.026600      -1.168500    
 H   0.4438000      -2.264400       2.106900    
 H   -1.303900      -2.384100       1.700400    
 H  -0.7756000      -1.842600       3.267700    
 H    4.513200      0.5107000      7.2999999E-02
 H    4.510100     -0.6458000       1.408300    
 H   -5.182000     -0.5147000      0.4594000    
 H  -0.6408000       3.351900      -2.530700    
 H   -3.029300      -3.205200      -2.107200    
 H  -0.2177000       4.265600       1.646400    
 H   -5.177300      -2.352900      -1.206600    
 H  -0.3970000       5.019200     -0.7100000    
 H    5.703100      -2.352700     -4.0100001E-02
 H    6.510500      0.3302000      -1.289500    
 H    7.372600      -1.311400      -1.424400    


%chk=000176882-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000176882

0 1
O -0.447993 -0.337338 1.877168
N 3.229059 -0.984021 -0.249660
C -0.517155 -0.212254 0.391079
C 0.762516 -0.821788 -0.252022
C -1.818978 -0.882274 -0.106734
C -0.570867 1.307491 0.123073
C 2.073748 -0.250172 0.317631
C -3.042560 -0.481124 0.493395
C -0.856561 1.772423 -1.185909
C -1.854654 -1.871752 -1.118974
C -0.312507 2.251996 1.145249
C -0.414085 -1.709310 2.390376
C 4.544890 -0.589248 0.307390
C -4.266919 -1.054411 0.095064
C -0.873027 3.154676 -1.471772
C -3.083275 -2.445803 -1.525430
C -0.336034 3.637179 0.860748
C -4.292902 -2.040926 -0.920793
C -0.611336 4.095266 -0.447680
C 5.643255 -1.480011 -0.233177
C 6.785044 -1.033752 -0.814281
H 0.778612 -1.918935 -0.111585
H 0.727717 -0.637836 -1.344563
H 2.085110 -0.384949 1.415984
H 2.119255 0.849211 0.132041
H -3.017623 0.282289 1.278923
H -1.086740 1.052374 -1.980672
H -0.930292 -2.206883 -1.600252
H -0.103205 1.890112 2.154936
H 3.239958 -0.936895 -1.278920
H 0.519294 -2.235913 2.107750
H -1.285502 -2.297412 2.042079
H -0.454422 -1.607993 3.486821
H 4.804874 0.482848 0.125357
H 4.481897 -0.716907 1.408589
H -5.200580 -0.732353 0.570155
H -1.098149 3.497454 -2.488216
H -3.092026 -3.209102 -2.311975
H -0.137598 4.357985 1.662525
H -5.243779 -2.485821 -1.235167
H -0.628145 5.169031 -0.666559
H 5.457974 -2.559179 -0.131379
H 6.985198 0.038204 -0.938706
H 7.553710 -1.725176 -1.177606


