%chk=000060326.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060326

2 1
 N   -1.412600      0.8244000      0.2438000    
 N    1.448600      0.9428000     -0.1541000    
 N   -4.925800     -0.3194000     -0.3135000    
 N    5.002900     -0.1967000      2.5200000E-02
 C  -0.7292000       2.100300     -1.5000000E-03
 C  -0.6864000     -0.2774000     -0.3997000    
 C   0.7219000       2.044600      0.4886000    
 C   0.7649000     -0.3334000      8.9100003E-02
 C   -2.795900      0.8780000     -0.2246000    
 C    2.831400      0.8889000      0.3163000    
 C   -3.513000     -0.4143000      0.1282000    
 C    3.592200     -0.1916000     -0.4338000    
 C   -5.681600      -1.620500     -9.3000000E-03
 C    5.802800      -1.300000     -0.6815000    
 C   -5.008800     -6.2399998E-02  -1.824700    
 C   -5.646700      0.8295000      0.4056000    
 C    5.679200       1.148500     -0.2744000    
 C    5.083400     -0.4443000       1.538100    
 C   -5.684700      -1.857200       1.485200    
 C    5.157300      -2.639800     -0.4030000    
 H   -2.790300       1.070000      -1.302300    
 H   -3.272800       1.732600      0.2653000    
 H    2.834600      0.7261000       1.399500    
 H    3.267500       1.873300      0.1249000    
 H  -0.7475000       2.357000      -1.069500    
 H   -1.241700       2.906900      0.5369000    
 H   -1.113900      -1.250700     -0.1428000    
 H  -0.7078000     -0.1804000      -1.493600    
 H   0.7372000       1.940200       1.582000    
 H    1.202400       3.000100      0.2452000    
 H    1.220600      -1.153800     -0.4725000    
 H   0.7901000     -0.6002000       1.154400    
 H   -3.099400      -1.294500     -0.3715000    
 H   -3.473700     -0.5616000       1.211800    
 H    3.177000      -1.171700     -0.2054000    
 H    3.578600     -3.0600000E-02  -1.518600    
 H   -5.176900      -2.432800     -0.5441000    
 H   -6.703300      -1.519000     -0.3926000    
 H    6.831600      -1.268400     -0.3055000    
 H    5.805200      -1.074600      -1.753800    
 H   -4.705500      0.9621000      -2.052500    
 H   -4.373500     -0.7919000      -2.335500    
 H   -6.051300     -0.1917000      -2.133400    
 H   -5.351100      0.8480000       1.458200    
 H   -5.379900       1.778200     -6.9399998E-02
 H   -6.726700      0.6834000      0.3019000    
 H    5.298100       1.922600      0.3955000    
 H    5.496100       1.401600      -1.322700    
 H    6.753600       1.033200     -9.8099999E-02
 H    4.362600      -1.214300       1.826000    
 H    4.862800      0.4865000       2.069500    
 H    6.104000     -0.7507000       1.788300    
 H   -6.155600      -1.058300       2.062400    
 H   -4.692400      -2.062300       1.894100    
 H   -6.275800      -2.758900       1.687600    
 H    4.204800      -2.772600     -0.9235000    
 H    5.027400      -2.868700      0.6567000    
 H    5.813100      -3.424000     -0.8011000    


%chk=000060326-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000060326

2 1
N -1.433785 0.528489 -0.137202
N 1.446760 0.582598 0.175292
N -5.203291 -0.351987 -0.319026
N 5.242356 -0.185207 0.271948
C -0.673420 1.804974 -0.239728
C -0.593775 -0.616151 -0.577874
C 0.601463 1.727018 0.616413
C 0.687877 -0.693265 0.272105
C -2.775467 0.565392 -0.762253
C 2.779429 0.542086 0.817083
C -3.734868 -0.227751 0.160403
C 3.794158 0.031988 -0.235483
C -6.023163 -1.158101 0.740662
C 6.167351 -0.531362 -0.938866
C -5.274935 -1.132860 -1.631423
C -5.827718 1.026078 -0.522809
C 5.784104 1.099904 0.899139
C 5.298131 -1.307277 1.306556
C -6.162702 -0.500769 2.116516
C 5.811329 -1.811130 -1.699676
H -2.764761 0.156702 -1.798300
H -3.102131 1.618356 -0.827939
H 2.788161 -0.093654 1.733627
H 3.042124 1.568276 1.128014
H -0.387645 2.029692 -1.294590
H -1.303403 2.631839 0.133776
H -1.156638 -1.559939 -0.456010
H -0.310719 -0.519184 -1.653923
H 0.309480 1.631997 1.689296
H 1.171169 2.665075 0.492145
H 1.310045 -1.527842 -0.100774
H 0.408715 -0.917258 1.330301
H -3.370114 -1.260697 0.299107
H -3.756938 0.266960 1.143094
H 3.459204 -0.934161 -0.644622
H 3.851696 0.758149 -1.063845
H -5.520339 -2.138114 0.818948
H -7.015901 -1.315481 0.283325
H 7.186306 -0.598194 -0.518618
H 6.125621 0.348680 -1.604306
H -4.740596 -0.586036 -2.420756
H -4.819553 -2.124496 -1.485662
H -6.330827 -1.250397 -1.920000
H -5.657388 1.642959 0.370624
H -5.373362 1.507090 -1.401198
H -6.909006 0.905992 -0.692096
H 5.212490 1.343343 1.805926
H 5.701883 1.920218 0.169548
H 6.841007 0.946775 1.166585
H 4.803627 -2.202995 0.905049
H 4.789660 -0.983173 2.225930
H 6.352119 -1.532975 1.531037
H -6.695019 0.464034 2.083903
H -5.201841 -0.369813 2.640696
H -6.773922 -1.175939 2.741526
H 4.826398 -1.766006 -2.192475
H 5.868647 -2.717845 -1.075029
H 6.560018 -1.934505 -2.502290


