%chk=000104629.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000104629

0 1
 N  -6.8000004E-02  0.5846000      0.9350000    
 C   0.5026000       1.114000     -0.3160000    
 C   0.7688000     -0.4040000       1.635900    
 C   -1.418300      7.2999999E-02  0.6958000    
 C    1.980800       1.449900     -0.2482000    
 C    1.479900      -1.412900      0.7553000    
 C    2.949900      0.4172000     -0.1702000    
 C    2.542300      -1.005800     -9.1100000E-02
 C   -2.364300       1.144700      0.1594000    
 C    2.386500       2.793600     -0.2814000    
 C    1.085700      -2.759600      0.7922000    
 C    4.308500      0.7812000     -0.1365000    
 C    3.181200      -1.984900     -0.8734000    
 C   -3.766300      0.6334000     -6.4599998E-02
 C    3.738900       3.125600     -0.2461000    
 C    1.735700      -3.708300      6.6000000E-03
 C    4.698400       2.121200     -0.1760000    
 C    2.782700      -3.322200     -0.8235000    
 C   -4.104900      9.5100001E-02  -1.296400    
 C   -4.691000      0.7105000      0.9652000    
 C   -5.400800     -0.3777000      -1.503600    
 C   -5.986800      0.2376000      0.7579000    
 C   -6.341600     -0.3065000     -0.4764000    
 H  -1.7700000E-02   2.040300     -0.5849000    
 H   0.3471000      0.4258000      -1.159100    
 H   0.1832000     -0.9218000       2.407800    
 H    1.529400      0.1334000       2.219600    
 H   -1.836100     -0.3008000       1.640200    
 H   -1.394700     -0.7834000      8.3999997E-03
 H   -2.395800       1.999200      0.8486000    
 H   -2.020100       1.550400     -0.7988000    
 H    1.650800       3.591900     -0.3392000    
 H   0.2697000      -3.076800       1.436900    
 H    5.084100      2.1500001E-02 -6.2500000E-02
 H    3.992000      -1.714100      -1.546700    
 H    4.043500       4.167600     -0.2738000    
 H    1.425000      -4.748300      4.2100001E-02
 H    5.753000       2.379300     -0.1455000    
 H    3.288300      -4.060900      -1.438900    
 H   -3.378700      3.2400001E-02  -2.101800    
 H   -4.423400       1.130700       1.930500    
 H   -5.676900     -0.8022000      -2.464400    
 H   -6.719400      0.2925000       1.557900    
 H   -7.350400     -0.6750000     -0.6375000    


%chk=000104629-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000104629

0 1
N -0.100159 0.654866 0.809423
C 0.594860 1.185098 -0.405309
C 0.757379 -0.302183 1.576485
C -1.439061 0.108682 0.475116
C 2.072416 1.486371 -0.203212
C 1.450474 -1.368318 0.728387
C 3.025085 0.421141 -0.125904
C 2.567754 -0.998811 -0.086133
C -2.441990 1.217292 0.049495
C 2.529750 2.825050 -0.191333
C 1.024820 -2.717746 0.749221
C 4.408679 0.736309 -0.070097
C 3.237570 -2.002127 -0.835374
C -3.851236 0.662900 -0.092894
C 3.908470 3.127817 -0.124660
C 1.692707 -3.706988 -0.007254
C 4.851666 2.076138 -0.073309
C 2.807508 -3.345610 -0.799096
C -4.276219 0.056347 -1.303615
C -4.757427 0.696719 0.998690
C -5.569478 -0.501066 -1.422130
C -6.052176 0.141626 0.885627
C -6.462896 -0.460726 -0.326439
H 0.077698 2.107732 -0.723364
H 0.502894 0.448938 -1.245247
H 0.119757 -0.775547 2.344086
H 1.522260 0.294938 2.107312
H -1.839072 -0.386850 1.379626
H -1.394623 -0.665749 -0.332742
H -2.406574 2.012445 0.817111
H -2.117984 1.664558 -0.908947
H 1.794925 3.637210 -0.243688
H 0.169399 -2.997084 1.377121
H 5.137977 -0.078317 0.006513
H 4.085018 -1.718859 -1.470520
H 4.243002 4.171047 -0.116354
H 1.350835 -4.747634 0.022349
H 5.923377 2.298561 -0.022953
H 3.331895 -4.104244 -1.390750
H -3.590745 0.028091 -2.160232
H -4.445933 1.167338 1.939851
H -5.881625 -0.961856 -2.366445
H -6.740523 0.182597 1.737717
H -7.467654 -0.888697 -0.417326


