%chk=000085354.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085354

0 1
 N    2.551400      0.8858000     -1.5000000E-03
 N   -2.053600       1.771700     -1.8000000E-03
 N  -0.5184000      -2.659100     -1.0000000E-03
 N   0.2548000       1.359900     -2.6000000E-03
 N    1.040300     -0.9075000     -2.0999999E-03
 N   -1.316100     -0.4541000     -2.7000001E-03
 C    3.704000      2.6000000E-03  7.9999998E-04
 C   -1.853800       3.187200      7.9999998E-04
 C   -1.844100      -3.194000      7.9999998E-04
 C    4.977400      0.8528000      3.1000001E-03
 C    3.645400     -0.8691000       1.257400    
 C    3.658100     -0.8720000      -1.255300    
 C   -3.220000       3.878700      3.4000000E-03
 C   -1.065700       3.564100       1.257700    
 C   -1.069400       3.577300      -1.255100    
 C   -1.759600      -4.722900      4.0000002E-03
 C   -2.565500      -2.699600       1.256800    
 C   -2.573100      -2.710300      -1.255900    
 C    1.246300      0.4336000     -2.2000000E-03
 C  -0.9864000      0.8476000     -2.6000000E-03
 C  -0.2519000      -1.272900     -2.0999999E-03
 H    2.690200       1.889900     -1.1000000E-03
 H   -2.988500       1.379700     -1.6000000E-03
 H   0.2885000      -3.272600       0.000000    
 H    5.017600       1.502200      0.8855000    
 H    5.876700      0.2270000      6.0999999E-03
 H    5.022100       1.500900     -0.8801000    
 H    2.888400      -1.656600       1.230200    
 H    3.465800     -0.2643000       2.154500    
 H    4.602100      -1.385900       1.403200    
 H    3.494300     -0.2672000      -2.155300    
 H    4.613200      -1.395600      -1.386700    
 H    2.894200      -1.653100      -1.237300    
 H   -3.806700       3.600200     -0.8799000    
 H   -3.116700       4.969400      6.6999998E-03
 H   -3.805800       3.595000      0.8857000    
 H  -2.0000001E-03   3.316200       1.225100    
 H   -1.491600       3.095400       2.153200    
 H   -1.105400       4.649400       1.414300    
 H  -8.0000004E-03   3.319400      -1.231900    
 H   -1.101800       4.664900      -1.396400    
 H   -1.503600       3.123100      -2.154000    
 H   -1.221800      -5.088000      0.8869000    
 H   -2.755900      -5.178900      6.5000001E-03
 H   -1.224200      -5.092100     -0.8787000    
 H   -2.883200      -1.654600       1.223500    
 H   -1.947200      -2.833300       2.152800    
 H   -3.485500      -3.277000       1.413200    
 H   -1.962100      -2.859700      -2.154300    
 H   -3.498800      -3.282200      -1.397700    
 H   -2.880500      -1.662000      -1.233500    


%chk=000085354-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085354

0 1
N 2.603891 0.756047 0.000988
N -1.955176 1.874026 0.000645
N -0.645194 -2.634080 0.000714
N 0.365435 1.362160 0.000512
N 1.001059 -0.999175 0.000557
N -1.361570 -0.368530 0.000285
C 3.843778 -0.072387 0.001309
C -1.854701 3.362127 0.001157
C -1.984963 -3.289214 0.001007
C 5.025401 0.929608 0.001781
C 3.903209 -0.956181 1.275980
C 3.904002 -0.955962 -1.273476
C -3.312274 3.886907 0.001752
C -1.117709 3.853298 1.275864
C -1.118425 3.854153 -1.273635
C -1.715016 -4.814632 0.002010
C -2.778859 -2.894683 1.275209
C -2.778645 -2.896285 -1.273822
C 1.295331 0.334791 0.000645
C -0.936960 0.950387 0.000233
C -0.353645 -1.290551 0.000244
H 2.702689 1.773387 0.001070
H -2.886499 1.452946 0.000708
H 0.184898 -3.230405 0.001119
H 5.001977 1.573580 0.901427
H 5.982992 0.381209 0.001784
H 5.002290 1.574049 -0.897545
H 3.034569 -1.633857 1.302824
H 3.891541 -0.327732 2.185097
H 4.830546 -1.558361 1.277517
H 3.893499 -0.327345 -2.182490
H 4.831048 -1.558597 -1.274250
H 3.035081 -1.633242 -1.301242
H -3.859353 3.545295 -0.897442
H -3.314780 4.990367 0.001901
H -3.858744 3.545018 0.901206
H -0.098712 3.434593 1.305035
H -1.659070 3.533264 2.184772
H -1.053742 4.957134 1.276126
H -0.099576 3.435159 -1.303835
H -1.054075 4.957968 -1.272981
H -1.660504 3.535095 -2.182456
H -1.147341 -5.118576 0.901946
H -2.671599 -5.364687 0.001949
H -1.146663 -5.119632 -0.897147
H -2.926373 -1.802889 1.301856
H -2.230630 -3.201111 2.184697
H -3.766137 -3.392552 1.275950
H -2.230506 -3.204245 -2.182842
H -3.766122 -3.393772 -1.273878
H -2.925774 -1.804482 -1.302036


