%chk=000017879.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017879

1 1
 N   -2.260400      0.2138000     -0.3632000    
 N  -0.2771000     -0.8738000      0.5969000    
 N  -9.5200002E-02   1.281300     -0.5202000    
 C   -3.853700      -1.383800      0.6262000    
 C   -5.200400     -0.6750000      0.4579000    
 C   -2.873100      -1.123800     -0.5117000    
 C   -5.123900      0.8523000      0.4769000    
 C   -4.315100       1.427700     -0.6810000    
 C   -2.840900       1.360400     -0.4272000    
 C  -0.7122000      0.2398000     -7.7900000E-02
 C   0.9480000      -1.517800      0.3248000    
 C    2.117000     -0.8366000     -6.7699999E-02
 C    2.273500      0.6396000      3.2099999E-02
 C    1.239000       1.569900     -0.1976000    
 C   0.9365000      -2.932400      0.3473000    
 C    3.207900      -1.627300     -0.5070000    
 C    3.537500       1.165300      0.4089000    
 C    1.516100       2.952800     -0.1081000    
 C    2.040000      -3.678600     -5.2499998E-02
 C    3.173900      -3.023200     -0.4988000    
 C    3.788200       2.535100      0.5059000    
 C    2.774400       3.434300      0.2361000    
 H   -3.412300      -1.120000       1.595600    
 H   -4.054600      -2.462000      0.6588000    
 H   -5.862200     -0.9966000       1.271500    
 H   -5.674300      -1.006600     -0.4745000    
 H   -2.105600      -1.899400     -0.5640000    
 H   -3.380800      -1.144500      -1.483300    
 H   -4.714300       1.189300       1.437200    
 H   -6.147200       1.242000      0.4130000    
 H   -4.561800       2.490500     -0.7923000    
 H   -4.563600      0.9435000      -1.632000    
 H   -2.283600       2.294500     -0.2666000    
 H  -0.9470000      -1.454900       1.091900    
 H   3.5700001E-02  -3.463200      0.6514000    
 H    4.123600      -1.158900     -0.8648000    
 H    4.365500      0.5003000      0.6506000    
 H   0.7223000       3.673700     -0.3003000    
 H    2.001900      -4.763200     -3.7500001E-02
 H    4.037200      -3.589900     -0.8347000    
 H    4.773600       2.889200      0.7930000    
 H    2.952900       4.502700      0.3039000    


%chk=000017879-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000017879

1 1
N -2.204160 0.261088 -0.248902
N -0.277783 -0.867608 0.657880
N -0.096751 1.273709 -0.504086
C -3.943586 -1.511089 0.371159
C -5.293712 -0.758489 0.303789
C -2.889566 -1.022125 -0.647137
C -5.221676 0.753072 0.615638
C -4.322306 1.575397 -0.371924
C -2.856609 1.406704 -0.139535
C -0.727666 0.245921 -0.034608
C 0.956006 -1.555578 0.349328
C 2.147682 -0.849892 0.019572
C 2.300366 0.641982 0.070659
C 1.266823 1.583236 -0.266027
C 0.920368 -2.967488 0.386386
C 3.271489 -1.641308 -0.351391
C 3.575660 1.178262 0.391040
C 1.562450 2.969355 -0.372603
C 2.070624 -3.722634 0.074077
C 3.246675 -3.050984 -0.321299
C 3.848230 2.563085 0.343024
C 2.841244 3.467367 -0.062014
H -3.527994 -1.465584 1.398023
H -4.125840 -2.580271 0.155108
H -5.997371 -1.230663 1.013520
H -5.731360 -0.899927 -0.705224
H -2.094300 -1.768712 -0.794458
H -3.362502 -0.841035 -1.631360
H -4.878880 0.921597 1.654373
H -6.237809 1.180986 0.547408
H -4.559959 2.647528 -0.283527
H -4.576576 1.268429 -1.409562
H -2.228414 2.263966 0.132531
H -0.923233 -1.353995 1.284647
H -0.009683 -3.480079 0.662694
H 4.185317 -1.137893 -0.681317
H 4.372703 0.498090 0.706882
H 0.756450 3.637318 -0.690646
H 2.038924 -4.815421 0.121311
H 4.138965 -3.617492 -0.603833
H 4.845054 2.928239 0.609311
H 3.048109 4.539434 -0.131910


