%chk=000155337.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155337

0 1
 N   -1.888000       1.173900      0.5649000    
 N   -2.818800      0.3116000      0.1622000    
 N   -3.047000       2.361700     -0.8268000    
 N    1.921800     -0.5267000       3.064600    
 C   0.4488000      0.1488000      0.9590000    
 C    1.240400       1.268200      0.2004000    
 C  -0.8771000      0.7608000       1.535600    
 C    2.599900      0.8399000     -0.3846000    
 C   0.1078000      -1.094500      0.1143000    
 C    3.226900       1.974300      -1.198400    
 C    1.277300     -0.2360000       2.143800    
 C  -6.0999999E-03  -2.301100      0.7545000    
 C  -6.4700000E-02 -0.9330000      -1.235800    
 C    4.584100       1.575800      -1.756200    
 C  -0.3147000      -3.426400     -9.8000001E-03
 C  -0.3733000      -2.058300      -2.000100    
 C   -2.016300       2.384200     -1.4000000E-02
 C  -0.4983000      -3.305100      -1.387100    
 C   -3.502500       1.081900     -0.6866000    
 H    1.423300       2.104400      0.8914000    
 H   0.6351000       1.692200     -0.6082000    
 H  -0.6569000       1.647300       2.146500    
 H   -1.375600      4.6300001E-02   2.206600    
 H    2.494400     -3.9600000E-02  -1.027000    
 H    3.282000      0.5616000      0.4272000    
 H    3.344600       2.863700     -0.5685000    
 H    2.564100       2.248100      -2.027500    
 H   9.9900000E-02  -2.429900       1.825800    
 H   3.3000000E-03  1.9900000E-02  -1.745400    
 H    5.281700       1.326600     -0.9502000    
 H    5.013200       2.400300      -2.334100    
 H    4.497100      0.7071000      -2.416600    
 H  -0.4193000      -4.396100      0.4681000    
 H  -0.5218000      -1.963300      -3.071900    
 H   -1.365700       3.226200      0.1762000    
 H  -0.7415000      -4.180700      -1.981800    
 H   -4.359300      0.6985000      -1.220300    


%chk=000155337-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155337

0 1
N -1.878151 1.255997 0.560915
N -2.960028 0.456092 0.156181
N -3.008522 2.520432 -0.911941
N 1.868884 -0.379092 3.135966
C 0.417353 0.169316 0.955243
C 1.187809 1.273741 0.150224
C -0.930535 0.759661 1.557644
C 2.576634 0.843946 -0.368255
C 0.132558 -1.102951 0.122152
C 3.281010 1.978704 -1.146736
C 1.230140 -0.160629 2.152414
C 0.270773 -2.394248 0.689206
C -0.323921 -0.992769 -1.215651
C 4.667046 1.559136 -1.681079
C -0.036259 -3.549639 -0.062832
C -0.628571 -2.146540 -1.968709
C -1.937951 2.478327 -0.085057
C -0.486868 -3.430822 -1.396283
C -3.597058 1.269412 -0.730023
H 1.300645 2.162117 0.805230
H 0.561367 1.587444 -0.705719
H -0.674546 1.585152 2.245910
H -1.446927 -0.030399 2.124675
H 2.470993 -0.042083 -1.023695
H 3.214554 0.534493 0.483517
H 3.391505 2.863798 -0.487064
H 2.639011 2.297965 -1.993567
H 0.630094 -2.503285 1.718990
H -0.449261 -0.010253 -1.682893
H 5.338968 1.265406 -0.853057
H 5.152384 2.383676 -2.234324
H 4.582591 0.695134 -2.366554
H 0.080598 -4.539102 0.392624
H -0.981623 -2.040924 -3.000353
H -1.229746 3.286456 0.076859
H -0.724046 -4.325993 -1.981584
H -4.502101 0.954925 -1.242173


