%chk=000133945.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133945

0 1
 O   -1.510100     -0.9574000      -1.442800    
 N   -2.520000      0.9195000      0.9440000    
 N    3.226400       1.403300     -0.8458000    
 C   -1.376200      -1.487000     -0.1234000    
 C   -2.696100     -0.9721000     -0.6246000    
 C  -0.6016000     -0.6607000      0.8609000    
 C   -1.046200      0.8627000      0.8677000    
 C   -3.188700      0.3903000     -0.2511000    
 C   0.8837000     -0.8165000      0.6238000    
 C  -0.4093000       1.771800     -0.2534000    
 C   -3.706400      -1.945000      -1.120600    
 C    1.564300      0.2406000      1.1200000E-02
 C    1.043000       1.477700     -0.4165000    
 C   -3.019800       2.253000       1.270000    
 C    1.639600      -1.947600      0.9532000    
 C    2.920000      0.1967000     -0.2549000    
 C    2.094500       2.186500     -0.9492000    
 C    3.014900      -1.993900      0.6808000    
 C    3.688100     -0.9217000      7.0699997E-02
 H   -1.236900      -2.554100     -8.7000001E-03
 H  -0.8207000      -1.058500       1.862200    
 H  -0.6535000       1.256500       1.818900    
 H   -3.086900       1.068200      -1.107900    
 H   -4.263300      0.3267000     -3.6899999E-02
 H  -0.5398000       2.828000      8.9999996E-03
 H  -0.8985000       1.613400      -1.220000    
 H   -4.262600      -1.526300      -1.965800    
 H   -3.249300      -2.882800      -1.455200    
 H   -4.421300      -2.188400     -0.3279000    
 H   -2.850300       2.975500      0.4646000    
 H   -2.547400       2.633100       2.182500    
 H   -4.096600       2.217200       1.470000    
 H    1.162400      -2.801900       1.426600    
 H    2.150800       3.169900      -1.394300    
 H    4.146900       1.677100      -1.160400    
 H    3.577600      -2.885400      0.9493000    
 H    4.751500     -0.9669000     -0.1348000    


%chk=000133945-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133945

0 1
O -1.544383 -0.887218 -1.614261
N -2.490936 0.947869 0.927886
N 3.338410 1.428858 -0.818410
C -1.409754 -1.444674 -0.211310
C -2.753609 -0.973895 -0.678021
C -0.598496 -0.636263 0.797466
C -1.012532 0.877956 0.803401
C -3.263689 0.387073 -0.202901
C 0.904787 -0.822894 0.613807
C -0.408242 1.737094 -0.374082
C -3.808859 -1.964938 -1.129711
C 1.603999 0.238061 0.001433
C 1.076876 1.491232 -0.468075
C -3.012132 2.257070 1.355256
C 1.658802 -1.948391 1.000648
C 3.013994 0.203797 -0.220466
C 2.163642 2.207828 -0.963452
C 3.069182 -1.993590 0.767314
C 3.772731 -0.928019 0.158823
H -1.214683 -2.527608 -0.206258
H -0.900018 -1.033767 1.789454
H -0.602968 1.296987 1.744988
H -3.289516 1.068379 -1.091975
H -4.312614 0.275368 0.136391
H -0.634705 2.805988 -0.197932
H -0.896854 1.433749 -1.318539
H -4.472113 -1.514078 -1.891577
H -3.335710 -2.856727 -1.574630
H -4.435882 -2.285664 -0.276514
H -2.962417 3.048670 0.567010
H -2.444009 2.613510 2.233052
H -4.072189 2.153386 1.654771
H 1.173185 -2.799746 1.493651
H 2.210712 3.197838 -1.414118
H 4.270042 1.723967 -1.100529
H 3.627176 -2.884522 1.078042
H 4.854974 -0.991186 0.000568


