%chk=000094642.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094642

1 1
 N    2.281600       1.173300      0.2266000    
 N   -4.044800       1.671200     -0.6432000    
 C    2.065000      -1.154800      0.4880000    
 C    1.442300      0.2546000      0.6052000    
 C    3.424900     -0.7978000     -3.6400001E-02
 C    3.499600      0.5849000     -0.1723000    
 C    2.155700      -1.831700       1.857800    
 C    1.290500      -2.016600     -0.5121000    
 C   7.4199997E-02  0.4628000       1.089600    
 C    4.502600      -1.602900     -0.3659000    
 C   -2.364000      0.6987000      0.7648000    
 C    4.643600       1.212800     -0.6381000    
 C    2.126200       2.635400      0.1674000    
 C  -0.9693000      0.4836000      0.2766000    
 C   -3.330200     -0.3394000      0.2938000    
 C    5.665600     -0.9893000     -0.8375000    
 C   -2.986900       1.921300      7.9200000E-02
 C    5.735100      0.4073000     -0.9723000    
 C   -4.277600      0.2904000     -0.5214000    
 C   -3.393700      -1.695000      0.5615000    
 C   -2.420900       3.293300      0.2481000    
 C   -5.309100     -0.4306000      -1.098800    
 C   -4.430600      -2.429100     -1.7999999E-02
 C   -5.379900      -1.802400     -0.8426000    
 H    2.700200      -2.781100       1.800900    
 H    2.672700      -1.196300       2.587100    
 H    1.159100      -2.042800       2.261600    
 H   0.2886000      -2.257400     -0.1394000    
 H    1.167000      -1.505400      -1.474500    
 H    1.805500      -2.964400     -0.7061000    
 H  -3.7200000E-02  0.6013000       2.160100    
 H    4.453000      -2.681300     -0.2629000    
 H   -2.435800      0.8327000       1.849800    
 H    4.714700       2.289100     -0.7486000    
 H    2.236100       2.961200     -0.8709000    
 H    2.882300       3.099000      0.8074000    
 H    1.133000       2.913700      0.5290000    
 H  -0.8201000      0.3460000     -0.7926000    
 H    6.526200      -1.597200      -1.103100    
 H    6.649400      0.8647000      -1.341100    
 H   -2.662700      -2.178800       1.199800    
 H   -2.275100       3.498400       1.311800    
 H   -3.101900       4.038600     -0.1712000    
 H   -1.459500       3.359400     -0.2671000    
 H   -6.047100      5.0700001E-02  -1.731300    
 H   -4.506200      -3.496600      0.1709000    
 H   -6.179600      -2.392000      -1.282900    


%chk=000094642-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094642

1 1
N 1.974388 0.585358 -0.557518
N -4.138759 1.955606 0.373241
C 2.476231 -1.020447 1.111358
C 1.409347 -0.131169 0.449119
C 3.708379 -0.708603 0.269663
C 3.368985 0.247210 -0.716236
C 2.680544 -0.604687 2.604091
C 2.074690 -2.525639 1.020108
C 0.043454 -0.117185 0.897035
C 5.020737 -1.200308 0.336528
C -2.470239 0.268170 0.807130
C 4.288106 0.738268 -1.660351
C 1.332400 1.630451 -1.376637
C -1.087948 0.333048 0.241653
C -3.490847 -0.245316 -0.206095
C 5.970866 -0.719426 -0.600283
C -3.044526 1.721633 1.064434
C 5.607971 0.234102 -1.584599
C -4.444030 0.797967 -0.418993
C -3.607452 -1.471540 -0.878839
C -2.426966 2.688498 2.028087
C -5.531944 0.631720 -1.292407
C -4.704261 -1.645351 -1.764186
C -5.649519 -0.608738 -1.966910
H 3.498648 -1.205846 3.036040
H 2.950858 0.460912 2.698082
H 1.771325 -0.796063 3.200331
H 1.148355 -2.724697 1.586332
H 1.925422 -2.844129 -0.025694
H 2.878529 -3.143441 1.455702
H -0.104493 -0.599710 1.871349
H 5.315065 -1.938926 1.089158
H -2.489723 -0.293350 1.761264
H 4.018754 1.464926 -2.432284
H 0.817257 1.190619 -2.248280
H 2.103207 2.328422 -1.733925
H 0.609133 2.193618 -0.766014
H -1.034108 0.742942 -0.774400
H 6.999653 -1.090979 -0.566885
H 6.357940 0.584437 -2.300184
H -2.889387 -2.284451 -0.724706
H -2.483348 2.303531 3.064832
H -2.961423 3.649833 1.988463
H -1.356558 2.862414 1.809365
H -6.258184 1.436486 -1.436287
H -4.826715 -2.596496 -2.292421
H -6.487311 -0.772171 -2.652530


