%chk=000156910.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156910

0 1
 O   0.3909000       1.386000      0.1270000    
 O   -1.892200      -2.171200       1.017900    
 O   -2.246000       2.002100      0.3158000    
 N   -1.345800     -0.1661000     -6.5700002E-02
 N   -3.597900      0.1391000     -0.2055000    
 N    1.779400       1.440400      0.1358000    
 C    3.611900     -0.1462000     -5.6800000E-02
 C   -1.938500      -1.488100     -0.2288000    
 C   -3.381400      -1.224800     -0.6267000    
 C    2.176000      0.1739000     -1.7700000E-02
 C  -5.4000001E-03  9.7400002E-02 -3.0700000E-02
 C   -2.382800      0.8135000      5.2099999E-02
 C    1.092700     -0.7150000     -0.1277000    
 C    4.023200      -1.133900       1.088700    
 C    4.024200     -0.8231000      -1.409100    
 C    4.595900       1.072100      9.5200002E-02
 C   -4.904300      0.7440000     -6.3900001E-02
 H   -1.410600      -2.078800     -0.9848000    
 H   -3.515300      -1.252700      -1.712800    
 H   -4.096300      -1.891600     -0.1361000    
 H    1.109500      -1.787100     -0.2588000    
 H    3.471900      -2.078100       1.011900    
 H    5.092800      -1.370000       1.053200    
 H    3.802100     -0.7009000       2.071300    
 H    5.093700      -1.060900      -1.431700    
 H    3.472800      -1.757300      -1.566500    
 H    3.803800     -0.1625000      -2.255800    
 H    5.643800      0.7534000      5.6499999E-02
 H    4.437300       1.803200     -0.7062000    
 H    4.435900       1.584900       1.050900    
 H   -5.413400      0.7066000      -1.030400    
 H   -4.815400       1.782700      0.2636000    
 H   -5.475100      0.1759000      0.6752000    
 H  -0.9600000      -2.210000       1.289300    


%chk=000156910-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156910

0 1
O 0.410541 1.551454 0.159173
O -1.716489 -2.181915 1.020174
O -2.419386 2.113427 0.275479
N -1.374326 -0.032539 -0.118052
N -3.622775 0.120040 -0.175301
N 1.904014 1.537167 0.179616
C 3.701900 -0.186050 -0.058132
C -1.833022 -1.426798 -0.229358
C -3.344873 -1.279130 -0.517259
C 2.235445 0.238528 -0.012401
C -0.016881 0.245479 -0.050338
C -2.480585 0.888392 0.028080
C 1.079150 -0.609042 -0.157967
C 3.955131 -1.233387 1.065200
C 3.992477 -0.828237 -1.446144
C 4.636271 1.033597 0.152436
C -4.964946 0.687129 -0.133660
H -1.278150 -1.939344 -1.038498
H -3.584629 -1.492247 -1.577625
H -3.899311 -1.981545 0.129079
H 1.079788 -1.680235 -0.346687
H 3.317324 -2.127872 0.940560
H 5.010781 -1.561133 1.039703
H 3.751569 -0.800231 2.060909
H 5.048499 -1.152335 -1.493985
H 3.354661 -1.712645 -1.628109
H 3.815493 -0.103287 -2.260643
H 5.690308 0.701448 0.115879
H 4.479936 1.797190 -0.628855
H 4.452137 1.515664 1.127997
H -5.471340 0.598876 -1.114822
H -4.872913 1.755383 0.122235
H -5.585989 0.186685 0.633080
H -0.772412 -2.185585 1.326933


