%chk=000064338.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064338

0 1
 N  -0.2820000      0.2215000      0.5381000    
 N   -3.066800      0.3619000     -0.2261000    
 C    1.141700      6.7000002E-02  0.2457000    
 C    3.192000      -1.347700      0.6756000    
 C    2.866700     -0.2557000      -1.573600    
 C    3.416200       1.153200      0.4441000    
 C    1.689600      -1.182700      0.9691000    
 C    1.365200     -9.3599997E-02  -1.274000    
 C    1.913400       1.311900      0.7386000    
 C    3.397800      -1.499800     -0.8411000    
 C    3.943900     -9.8499998E-02   1.165900    
 C    3.620200      0.9877000      -1.071500    
 C  -0.8280000       1.404200     -0.1387000    
 C   -1.027800     -0.9818000      0.1493000    
 C   -2.321900       1.565500      0.1634000    
 C   -2.521200     -0.8199000      0.4526000    
 C   -4.490900      0.5163000      6.4300001E-02
 C   -5.259300     -0.7269000     -0.3769000    
 C   -6.748700     -0.5827000     -0.1050000    
 H    3.575200      -2.235100       1.191800    
 H    3.020200     -0.3693000      -2.652800    
 H    3.958300       2.038000      0.7963000    
 H    1.218400      -2.112700      0.6348000    
 H    1.529700      -1.106400       2.052500    
 H    1.030800      0.7739000      -1.851200    
 H   0.8649000     -0.9729000      -1.691100    
 H    1.760700       1.460600       1.815600    
 H    1.601700       2.234200      0.2381000    
 H    4.463400      -1.637000      -1.061900    
 H    2.880500      -2.397100      -1.202300    
 H    3.817600      1.3000000E-02   2.249800    
 H    5.019100     -0.2121000      0.9805000    
 H    4.689700      0.8927000      -1.296300    
 H    3.263200       1.881200      -1.598100    
 H  -0.7358000       1.366900      -1.228500    
 H  -0.3667000       2.331100      0.2111000    
 H  -0.7233000      -1.858200      0.7275000    
 H  -0.9413000      -1.226200     -0.9140000    
 H   -2.460700       1.783200       1.231300    
 H   -2.697700       2.430900     -0.3965000    
 H   -2.982400      -1.745200      9.5899999E-02
 H   -2.678600     -0.7614000       1.538200    
 H   -4.659900      0.6988000       1.133700    
 H   -4.883300       1.384200     -0.4802000    
 H   -5.102600     -0.9154000      -1.445700    
 H   -4.951300      -1.622600      0.1697000    
 H   -6.941600     -0.4372000      0.9628000    
 H   -7.165400      0.2710000     -0.6490000    
 H   -7.282900      -1.482300     -0.4270000    


%chk=000064338-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000064338

0 1
N -0.294122 0.141327 0.239192
N -3.194062 0.276072 -0.150720
C 1.199893 0.031410 0.045611
C 3.277546 -1.276068 0.798032
C 3.181230 -0.310614 -1.545038
C 3.439264 1.217431 0.461272
C 1.734742 -1.154981 0.906167
C 1.633869 -0.197290 -1.441947
C 1.893826 1.329217 0.561914
C 3.670316 -1.508799 -0.686927
C 3.940228 0.025673 1.315755
C 3.836945 0.996533 -1.023679
C -0.950609 1.354763 -0.312632
C -1.087290 -1.045875 -0.172702
C -2.391145 1.467928 0.218122
C -2.527250 -0.946416 0.360689
C -4.603408 0.404043 0.295825
C -5.549828 -0.642489 -0.328312
C -7.020881 -0.397400 0.072286
H 3.614572 -2.136201 1.410310
H 3.466266 -0.471602 -2.604266
H 3.890633 2.159637 0.831011
H 1.288195 -2.110493 0.570831
H 1.422198 -0.995623 1.956630
H 1.274144 0.642121 -2.070542
H 1.168375 -1.123589 -1.833787
H 1.577500 1.510559 1.608240
H 1.576110 2.203806 -0.037713
H 4.769709 -1.618515 -0.777785
H 3.215263 -2.450328 -1.055996
H 3.681314 0.185761 2.381781
H 5.044225 -0.053169 1.252933
H 4.939756 0.932421 -1.117559
H 3.505722 1.858410 -1.637866
H -0.987957 1.344672 -1.430680
H -0.401946 2.255884 0.004926
H -0.632100 -1.962292 0.237066
H -1.138896 -1.151882 -1.284577
H -2.346259 1.604766 1.329543
H -2.871369 2.364405 -0.219243
H -3.092281 -1.835405 0.027263
H -2.496847 -0.952250 1.481314
H -4.685378 0.353219 1.415095
H -4.953289 1.412915 -0.001730
H -5.438180 -0.601623 -1.428544
H -5.254771 -1.662563 -0.014463
H -7.148039 -0.438342 1.170938
H -7.367359 0.596705 -0.268655
H -7.688577 -1.157369 -0.372583


