%chk=000081280.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081280

1 1
 N  -0.2688000      6.9399998E-02  8.0499999E-02
 N  -0.9390000       2.715700      3.7000000E-03
 N    4.417700       1.161900      4.4000000E-02
 N   -4.937100      -1.175900      0.1257000    
 C   -1.570700      0.4051000      7.3200002E-02
 C   0.7165000      0.9837000      5.2200001E-02
 C   -1.898100       1.772300      3.3399999E-02
 C   0.1381000      -1.309700      0.1215000    
 C   -2.561400     -0.5825000      0.1044000    
 C   0.3535000       2.342000      1.3000000E-02
 C   -3.247600       2.112800      2.5599999E-02
 C    2.057900      0.5863000      6.2300000E-02
 C   -3.902400     -0.2139000      9.6400000E-02
 C   0.3282000      -1.995200      -1.057600    
 C   -4.245700       1.134200      5.7000000E-02
 C    3.062100       1.548200      3.3799998E-02
 C    1.378400       3.283300     -1.5400000E-02
 C   0.3221000      -1.893000       1.356100    
 C   -2.324600      -2.064000      0.1437000    
 C    2.722200       2.897200     -4.9999999E-03
 C   -3.664100       3.549700     -1.6600000E-02
 C   0.7220000      -3.332100      -1.000000    
 C   0.9158000      -3.949500      0.2358000    
 C   0.7159000      -3.229800       1.413700    
 C   0.1242000      -1.352200      -2.389800    
 C    1.338300      -5.378500      0.2976000    
 C    5.421500       2.019100      0.6435000    
 C    4.825000     -0.1044000     -0.5327000    
 H    2.358000     -0.4533000      0.1092000    
 H   -5.293900       1.425500      4.9699999E-02
 H    1.138200       4.344100     -4.8700001E-02
 H   0.1714000      -1.335200       2.275600    
 H   -3.237700      -2.657700      0.2424000    
 H   -1.950300      -2.463700     -0.7951000    
 H   -1.865400      -2.391200       1.070300    
 H    3.477000       3.677900     -4.0300000E-02
 H   -3.283600       4.029600     -0.9245000    
 H   -4.753600       3.662400     -1.8800000E-02
 H   -3.281700       4.082600      0.8603000    
 H   0.8814000      -3.896300      -1.915800    
 H   0.8661000      -3.698300       2.382700    
 H   0.8813000     -0.5816000      -2.564900    
 H   0.2086000      -2.080500      -3.204200    
 H  -0.8707000     -0.9047000      -2.471600    
 H   -5.884600     -0.8336000      0.2383000    
 H   -4.841100      -2.034300     -0.3996000    
 H    2.429500      -5.449800      0.2523000    
 H   0.9946000      -5.854400       1.222300    
 H   0.9129000      -5.950700     -0.5339000    
 H    5.694200       2.832400     -3.7300002E-02
 H    6.335700       1.458900      0.8696000    
 H    5.071300       2.445300       1.590400    
 H    4.639200     -0.9271000      0.1659000    
 H    5.896000     -0.1053000     -0.7644000    
 H    4.300500     -0.3057000      -1.473700    


%chk=000081280-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081280

1 1
N -0.274347 -0.065560 0.185002
N -0.947538 2.682118 0.034533
N 4.461967 1.258042 0.232478
N -5.136381 -0.961229 -0.030028
C -1.649352 0.290768 0.148023
C 0.751228 0.909120 0.187151
C -1.921466 1.732707 0.007408
C 0.177878 -1.457237 0.100342
C -2.728940 -0.635158 0.228727
C 0.351076 2.303303 0.148478
C -3.279863 2.214817 -0.164386
C 2.117285 0.570400 0.196822
C -4.049152 -0.115016 -0.001285
C 0.184508 -2.114743 -1.157081
C -4.304142 1.286970 -0.196967
C 3.122077 1.587434 0.214938
C 1.371196 3.313013 0.178252
C 0.676217 -2.085292 1.263900
C -2.655667 -2.117853 0.570827
C 2.712412 2.980563 0.215828
C -3.536648 3.695054 -0.313715
C 0.666989 -3.449308 -1.188633
C 1.142444 -4.119576 -0.033457
C 1.149418 -3.409982 1.198932
C -0.301514 -1.431490 -2.420476
C 1.623426 -5.556152 -0.102829
C 5.502770 2.308834 0.265512
C 4.879786 -0.157968 0.221165
H 2.408446 -0.478637 0.198528
H -5.337033 1.618445 -0.351665
H 1.038887 4.354771 0.158247
H 0.673790 -1.539522 2.213651
H -3.464163 -2.375590 1.282491
H -2.767401 -2.765141 -0.321956
H -1.722381 -2.407934 1.060703
H 3.461933 3.774134 0.234399
H -2.977997 4.111167 -1.169800
H -4.610722 3.897379 -0.456272
H -3.186063 4.246996 0.575803
H 0.673685 -3.977679 -2.149654
H 1.520678 -3.898564 2.106724
H 0.201168 -0.459520 -2.578982
H -0.110098 -2.058329 -3.306269
H -1.388053 -1.226919 -2.381989
H -6.073400 -0.588001 -0.170193
H -5.039798 -1.968655 0.067929
H 2.536619 -5.707222 0.499437
H 0.856960 -6.247993 0.295638
H 1.840763 -5.866184 -1.138530
H 5.458350 2.951981 -0.632937
H 6.493857 1.833994 0.292513
H 5.406772 2.944756 1.164833
H 4.503399 -0.695338 1.112611
H 5.977441 -0.215724 0.225339
H 4.511890 -0.677748 -0.683860


