%chk=000041336.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041336

0 1
 N   -1.303700      0.8126000      0.6829000    
 N    1.015500      0.6408000      0.1187000    
 C   -1.877100      0.4106000     -0.5876000    
 C   -2.040200      -1.112000     -0.6326000    
 C   -3.213000       1.126100     -0.8118000    
 C    2.353900      0.8336000      0.6937000    
 C   -3.151700      -1.615500      0.2884000    
 C   -4.320200      0.6147000      0.1100000    
 C   -4.472300     -0.9005000      2.1100000E-02
 C    2.806200     -0.4645000       1.363600    
 C    3.313000       1.276400     -0.4118000    
 C    3.117900      -1.571400      0.3569000    
 C    3.622300      0.1594000      -1.408300    
 C    4.107500      -1.104600     -0.7059000    
 C   4.2100001E-02  0.8940000      0.9226000    
 H   -1.201000      0.7161000      -1.396000    
 H   -1.098800      -1.609200     -0.3693000    
 H   -2.276600      -1.411300      -1.661900    
 H   -3.525900      0.9752000      -1.853000    
 H   -3.094700       2.207300     -0.6705000    
 H    2.332500       1.632700       1.447300    
 H   -2.860600      -1.467900       1.335500    
 H   -3.283600      -2.694200      0.1465000    
 H   -5.268500       1.092100     -0.1629000    
 H   -4.113900      0.9035000       1.147000    
 H   -4.838200      -1.172100     -0.9767000    
 H   -5.227200      -1.238300      0.7401000    
 H    2.048200     -0.8216000       2.070900    
 H    3.711600     -0.2613000       1.949900    
 H    4.253700       1.608200      4.5800000E-02
 H    2.900100       2.138000     -0.9501000    
 H    2.190700      -1.902700     -0.1266000    
 H    3.527900      -2.440600      0.8837000    
 H    4.385000      0.5018000      -2.117000    
 H    2.725000     -7.0400000E-02  -1.995700    
 H    5.081100     -0.9119000     -0.2387000    
 H    4.259300      -1.900800      -1.443300    
 H   -1.944200      0.9928000       1.450700    
 H   0.2254000       1.216600       1.962700    


%chk=000041336-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000041336

0 1
N -1.330829 1.087371 0.627870
N 0.947663 0.493666 0.421471
C -1.761878 0.359053 -0.585341
C -1.890956 -1.169551 -0.327660
C -3.100275 0.942360 -1.101896
C 2.325371 0.624359 0.945943
C -3.077335 -1.502440 0.605929
C -4.298016 0.602126 -0.177935
C -4.406226 -0.923957 0.059974
C 2.881293 -0.780160 1.312048
C 3.233483 1.290445 -0.125861
C 3.048105 -1.677581 0.063482
C 3.403300 0.396605 -1.376592
C 3.952448 -0.999584 -0.994631
C -0.013428 1.115112 1.052500
H -0.964808 0.513726 -1.337676
H -0.936482 -1.536993 0.090521
H -2.036042 -1.673693 -1.305608
H -3.294055 0.508783 -2.102789
H -3.005565 2.037606 -1.237095
H 2.350224 1.261262 1.867423
H -2.878845 -1.080074 1.612497
H -3.161860 -2.598855 0.733997
H -5.233594 0.989718 -0.625474
H -4.192113 1.116698 0.801508
H -4.651308 -1.421814 -0.901367
H -5.238705 -1.144137 0.756372
H 2.207420 -1.260175 2.047644
H 3.867569 -0.645918 1.804200
H 4.228024 1.479306 0.330654
H 2.806726 2.272658 -0.406484
H 2.048602 -1.857208 -0.377639
H 3.466724 -2.660693 0.356030
H 4.075416 0.889722 -2.106222
H 2.414663 0.276220 -1.859925
H 4.980027 -0.892326 -0.585801
H 4.031023 -1.638898 -1.896021
H -2.032826 1.566227 1.189658
H 0.144567 1.722734 1.970597


