%chk=000152047.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152047

0 1
 O    2.445500      -2.372900      0.7610000    
 O    2.452900       2.358100      1.6300000E-02
 O    3.831400      1.5600000E-02  0.5484000    
 N   -2.422600      0.1060000       1.047200    
 N   -4.455600     -8.8900000E-02 -0.2321000    
 N   -4.520000      0.2794000       2.084700    
 C  -0.2938000     -5.3300001E-02  7.0400000E-02
 C   -1.730800     -7.7200003E-02 -9.6000001E-02
 C   0.4009000       1.151600     -3.6899999E-02
 C   0.3971000      -1.235100      0.3384000    
 C    1.782500      -1.211900      0.4989000    
 C    1.786300       1.174700      0.1234000    
 C    2.477100     -7.0000002E-03  0.3914000    
 C   -2.320100     -0.2699000      -1.328100    
 C   -1.552300     -0.4733000      -2.584600    
 C   -3.700100     -0.2663000      -1.335800    
 C   -3.762100      8.9000002E-02  0.9086000    
 C    2.908900      -3.121800     -0.3607000    
 C    1.671900       3.519200     -0.2591000    
 C    4.602800      0.4839000     -0.5553000    
 H  -0.1872000       2.039800     -0.2461000    
 H  -0.1365000      -2.179300      0.4249000    
 H  -0.9182000      0.3936000      -2.796700    
 H  -0.9288000      -1.370700      -2.517500    
 H   -2.217000     -0.6054000      -3.445600    
 H   -4.265600     -0.4095000      -2.251100    
 H    3.618300      -2.534300     -0.9518000    
 H    2.067300      -3.434600     -0.9868000    
 H    3.419100      -4.014700      1.0700000E-02
 H   0.9676000       3.734000      0.5518000    
 H    1.178900       3.452300      -1.234900    
 H    2.363400       4.366700     -0.3110000    
 H    4.837200       1.544200     -0.4258000    
 H    4.097600      0.3189000      -1.513400    
 H    5.545200     -7.1699999E-02 -0.5671000    
 H   -4.044100      0.4171000       2.965600    
 H   -5.529200      0.2748000       2.031900    


%chk=000152047-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152047

0 1
O 2.328736 -2.605917 -0.505559
O 2.466574 2.172409 0.609943
O 3.853762 -0.212588 0.238448
N -2.457271 0.878772 0.516492
N -4.690712 0.235539 -0.234421
N -4.374077 1.958424 1.327005
C -0.391547 -0.142360 -0.202948
C -1.882253 -0.086246 -0.277476
C 0.307223 1.048559 0.135957
C 0.345020 -1.326984 -0.414459
C 1.758638 -1.339476 -0.314570
C 1.708286 1.044695 0.243748
C 2.466083 -0.149336 0.014698
C -2.695778 -0.917228 -1.117808
C -2.192048 -1.953476 -2.103786
C -4.095009 -0.686974 -1.033847
C -3.817970 0.995812 0.513228
C 3.717503 -2.747381 -0.975974
C 1.730026 3.386945 0.971464
C 4.707550 0.700214 -0.553033
H -0.285801 1.942328 0.339245
H -0.135619 -2.281719 -0.630382
H -1.272533 -1.621866 -2.616323
H -1.966544 -2.922820 -1.619249
H -2.961914 -2.147883 -2.872178
H -4.777299 -1.279745 -1.656665
H 4.435992 -2.494259 -0.181552
H 3.904567 -2.108679 -1.860993
H 3.801663 -3.808686 -1.259033
H 1.047467 3.199617 1.821881
H 1.152339 3.778657 0.112211
H 2.502682 4.113234 1.264372
H 4.460641 1.750504 -0.330859
H 4.585306 0.499977 -1.636179
H 5.737941 0.469853 -0.241454
H -3.768877 2.520307 1.918123
H -5.384847 2.058876 1.349130


