%chk=000052690.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052690

0 1
 N    1.165600     -0.2297000     -0.6029000    
 N    4.402000     -0.2875000      0.1130000    
 C   -1.605200      0.8951000      -1.792100    
 C   -1.792000     -0.6079000      -1.798400    
 C   -2.968000      0.3026000      -2.041800    
 C   0.1743000     -9.8700002E-02  0.4690000    
 C   -1.365800       1.696500     -0.5316000    
 C   -1.757700      -1.453600     -0.5446000    
 C  -0.5198000       1.257200      0.5146000    
 C  -0.8312000      -1.243300      0.5044000    
 C    3.260500     -0.3220000     -0.7652000    
 C    2.240100      0.7826000     -0.4561000    
 C    2.163300      -1.277500     -0.2755000    
 C   -1.980200       2.957800     -0.3942000    
 C   -2.662800      -2.526900     -0.4168000    
 C  -0.3290000       2.070500       1.648600    
 C  -0.8471000      -2.087300       1.631900    
 C   -1.781400       3.754700      0.7332000    
 C   -2.666800      -3.357100      0.7041000    
 C  -0.9550000       3.310000       1.755800    
 C   -1.758000      -3.136200       1.729700    
 C    5.099500      0.9936000     -4.6000001E-03
 C    5.314600      -1.393000     -0.1807000    
 H   -1.099300       1.292300      -2.671400    
 H   -1.398200      -1.109700      -2.681500    
 H   -3.724800      0.3935000      -1.270900    
 H   -3.362600      0.3559000      -3.050000    
 H   0.7193000     -0.1620000       1.423800    
 H    3.482900     -0.4106000      -1.838000    
 H    2.326700       1.233300      0.5418000    
 H    2.198900       1.590800      -1.194100    
 H    2.058500      -2.194200     -0.8657000    
 H    2.239700      -1.564600      0.7822000    
 H   -2.628100       3.328200      -1.186700    
 H   -3.380600      -2.720900      -1.211800    
 H   0.3121000       1.742100       2.463500    
 H  -0.1457000      -1.931700       2.448400    
 H   -2.271200       4.720800      0.8088000    
 H   -3.378400      -4.174400      0.7723000    
 H  -0.7968000       3.925300       2.636300    
 H   -1.756600      -3.778400       2.605300    
 H    4.485800       1.832400      0.3384000    
 H    5.416000       1.196300      -1.034700    
 H    5.992900       1.000400      0.6311000    
 H    6.155700      -1.394700      0.5216000    
 H    5.715300      -1.339200      -1.199700    
 H    4.807700      -2.357300     -6.3299999E-02


%chk=000052690-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000052690

0 1
N 1.145502 -0.034912 -0.371754
N 4.522240 -0.334523 -0.017734
C -1.510701 0.918298 -1.719134
C -1.611431 -0.602284 -1.733290
C -2.825316 0.246051 -2.172006
C 0.118350 0.025637 0.702277
C -1.442829 1.736232 -0.457746
C -1.654125 -1.444080 -0.486558
C -0.648935 1.353174 0.662038
C -0.819766 -1.186125 0.639801
C 3.252924 -0.204184 -0.749041
C 2.296008 0.943924 -0.288412
C 2.114028 -1.196693 -0.344599
C -2.151924 2.963134 -0.407668
C -2.518687 -2.567824 -0.456298
C -0.586944 2.208608 1.789105
C -0.875096 -2.059120 1.753681
C -2.083605 3.810312 0.719302
C -2.565859 -3.433655 0.657393
C -1.293105 3.431115 1.827402
C -1.736586 -3.177966 1.772570
C 5.408954 0.826984 -0.239762
C 5.198002 -1.615147 -0.314161
H -0.897273 1.332357 -2.529332
H -1.057026 -1.078891 -2.551717
H -3.675634 0.295400 -1.483587
H -3.087679 0.273398 -3.234399
H 0.628936 -0.018184 1.700367
H 3.400662 -0.186659 -1.857271
H 2.535685 1.248436 0.755797
H 2.185479 1.834764 -0.928549
H 1.857839 -2.021452 -1.029989
H 2.295288 -1.591545 0.680558
H -2.768168 3.247346 -1.269316
H -3.164282 -2.755119 -1.322994
H 0.021994 1.907788 2.650783
H -0.234799 -1.854523 2.620759
H -2.641999 4.753183 0.734876
H -3.243199 -4.295201 0.657412
H -1.229711 4.076437 2.710648
H -1.762178 -3.838954 2.646081
H 4.890145 1.755354 0.057304
H 5.734577 0.938311 -1.305794
H 6.314257 0.725801 0.385374
H 6.103678 -1.709051 0.311538
H 5.505357 -1.715327 -1.386637
H 4.526050 -2.457130 -0.071819


