%chk=000003079.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003079

0 1
 N   -1.851000      -1.814100      0.6118000    
 C  -0.5323000      0.7750000      0.2279000    
 C   -1.478800      0.1587000     -0.8421000    
 C   -1.412000      -1.378400     -0.7288000    
 C  -0.9405000      0.2577000       1.635500    
 C  -0.6461000       2.324400      0.1640000    
 C   -2.922100      0.6861000     -0.7574000    
 C   0.9080000      0.2903000     -4.1800000E-02
 C   7.9999998E-04  -1.827500      -1.162800    
 C   -1.049100      -1.272000       1.709800    
 C   -2.079800       2.858600      0.1891000    
 C   -2.955900       2.205000     -0.8689000    
 C    1.134500     -0.9507000     -0.6797000    
 C    2.024900       1.027100      0.3938000    
 C   -2.002700      -3.260800      0.7295000    
 C    2.449300      -1.394000     -0.9044000    
 C    3.325600      0.5710000      0.1702000    
 C    3.538200     -0.6364000     -0.4830000    
 C    4.488900       1.379800      0.6373000    
 H   -1.109500      0.4415000      -1.840900    
 H   -2.122300      -1.799700      -1.453500    
 H   -1.909200      0.6770000       1.931200    
 H  -0.2235000      0.5987000       2.393800    
 H  -0.1649000       2.685000     -0.7557000    
 H  -0.1077000       2.788500      0.9991000    
 H   -3.407200      0.3808000      0.1765000    
 H   -3.518100      0.2554000      -1.571200    
 H   3.3100002E-02  -1.808300      -2.261300    
 H   0.1880000      -2.866500     -0.8710000    
 H  -5.0000001E-02  -1.723500       1.734300    
 H   -1.520800      -1.525400       2.667700    
 H   -2.063600       3.943000      2.8100001E-02
 H   -2.520900       2.702200       1.180000    
 H   -3.987300       2.560500     -0.7663000    
 H   -2.613000       2.507300      -1.866100    
 H    1.893300       1.967000      0.9229000    
 H   -1.044900      -3.790700      0.7178000    
 H   -2.628200      -3.655300     -7.8699999E-02
 H   -2.512500      -3.512500       1.666400    
 H    2.627500      -2.340700      -1.409000    
 H    4.544500      -1.002600     -0.6671000    
 H    5.395300      0.7705000      0.7204000    
 H    4.684900       2.196300     -6.4900003E-02
 H    4.294700       1.803300       1.628500    


%chk=000003079-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003079

0 1
N -1.848413 -1.830092 0.614441
C -0.533172 0.768325 0.224926
C -1.490611 0.151875 -0.850450
C -1.424799 -1.391142 -0.745762
C -0.953663 0.249475 1.641491
C -0.629249 2.324472 0.170349
C -2.936724 0.693160 -0.774290
C 0.906942 0.278266 -0.053789
C -0.006354 -1.858776 -1.192576
C -1.012917 -1.288924 1.712103
C -2.078199 2.867946 0.226061
C -2.969323 2.234451 -0.865939
C 1.136511 -0.975626 -0.694009
C 2.028338 1.031198 0.379720
C -2.083857 -3.277475 0.736251
C 2.469938 -1.413372 -0.886858
C 3.362604 0.598736 0.187144
C 3.570902 -0.646250 -0.456405
C 4.533726 1.456809 0.637507
H -1.085681 0.430362 -1.848445
H -2.163987 -1.827967 -1.448065
H -1.948372 0.653149 1.902906
H -0.233037 0.624283 2.394373
H -0.151288 2.670964 -0.769185
H -0.051788 2.769625 1.004232
H -3.413750 0.347874 0.161821
H -3.524226 0.250606 -1.604375
H 0.014077 -1.872965 -2.302498
H 0.167839 -2.907121 -0.877194
H 0.022166 -1.712344 1.700519
H -1.471976 -1.595845 2.672346
H -2.055215 3.969483 0.111054
H -2.522640 2.667573 1.221371
H -4.009135 2.604593 -0.775147
H -2.601321 2.551090 -1.864565
H 1.867904 1.991531 0.883569
H -1.154873 -3.901534 0.700567
H -2.750752 -3.616214 -0.077742
H -2.585254 -3.489348 1.699142
H 2.643684 -2.380172 -1.377569
H 4.592372 -1.013257 -0.615220
H 5.457907 0.860187 0.733655
H 4.738442 2.268349 -0.087980
H 4.334820 1.935640 1.613515


