%chk=000014711.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014711

0 1
 N   0.2041000       2.447400      0.7525000    
 N    4.976700     -4.3499999E-02 -8.5299999E-02
 C    2.142300       1.903700     -0.6501000    
 C    2.403300      0.5548000      7.4199997E-02
 C   0.6643000       2.305300     -0.6247000    
 C    1.554600     -0.5776000     -0.4161000    
 C   0.6573000      -1.254500      0.4259000    
 C   -1.229500       2.740700      0.7885000    
 C  -0.1167000      -2.316800     -9.8700002E-02
 C    1.687200     -0.9431000      -1.756100    
 C   0.9553000       3.498700       1.440100    
 C   -2.036800       1.679200      8.9599997E-02
 C   0.5110000     -0.9004000       1.777100    
 C   2.9200001E-02  -2.670800      -1.450000    
 C    3.850000      0.2254000     -1.3900000E-02
 C   0.9257000      -1.987500      -2.272100    
 C   -1.014100      -2.993700      0.7430000    
 C  -0.3853000      -1.584000       2.599100    
 C   -2.304300       1.806400      -1.266400    
 C   -2.501800      0.5884000      0.8109000    
 C   -1.146400      -2.628700       2.083100    
 C   -3.052100      0.8230000      -1.914100    
 C   -3.249500     -0.3949000      0.1631000    
 C   -3.524600     -0.2775000      -1.199400    
 H    2.791800       2.690900     -0.2480000    
 H    2.444100       1.822100      -1.704100    
 H    2.262200      0.7665000       1.132500    
 H   0.5397000       3.241100      -1.185700    
 H   0.1368000       1.528500      -1.179100    
 H   -1.447500       3.720200      0.3396000    
 H   -1.570800       2.808500       1.830200    
 H    2.379300     -0.4308000      -2.419200    
 H    1.990000       3.205600       1.640600    
 H   0.5212000       3.689900       2.429200    
 H   0.9513000       4.445600      0.8879000    
 H    1.060000     -0.1054000       2.265100    
 H  -0.5564000      -3.483500      -1.874800    
 H    1.028800      -2.271600      -3.315300    
 H   -1.620300      -3.812300      0.3608000    
 H  -0.4906000      -1.300400       3.642400    
 H   -1.957500       2.665700      -1.833700    
 H   -2.313800      0.5022000       1.876500    
 H   -1.845200      -3.159300       2.723100    
 H   -3.269600      0.9162000      -2.974000    
 H   -3.633500      -1.243500      0.7212000    
 H   -4.110000      -1.041300      -1.702700    


%chk=000014711-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000014711

0 1
N 0.240904 2.896890 0.454042
N 4.464139 -0.212362 1.375265
C 2.269880 1.768640 -0.537945
C 2.093625 0.517432 0.374805
C 0.927309 2.487109 -0.797953
C 1.384037 -0.695234 -0.263718
C 0.700419 -1.650330 0.582300
C -1.175085 3.295163 0.213234
C 0.029810 -2.781833 -0.031910
C 1.406054 -0.901232 -1.646813
C 0.968056 3.951191 1.196640
C -2.064488 2.152628 -0.263717
C 0.652958 -1.536290 2.013711
C 0.074029 -2.944013 -1.455063
C 3.402050 0.106242 0.931600
C 0.754761 -2.022216 -2.247247
C -0.666109 -3.725144 0.794775
C -0.031763 -2.471374 2.793926
C -2.965765 2.343054 -1.340084
C -2.038975 0.895805 0.392084
C -0.703376 -3.575412 2.181839
C -3.829352 1.301347 -1.752516
C -2.891889 -0.149773 -0.022619
C -3.793761 0.050664 -1.094648
H 2.982652 2.456279 -0.047142
H 2.732538 1.497070 -1.503519
H 1.467608 0.876713 1.218350
H 1.121560 3.368870 -1.461191
H 0.245692 1.810474 -1.343480
H -1.243993 4.142118 -0.516398
H -1.563065 3.680032 1.177575
H 1.929115 -0.195223 -2.299285
H 1.975413 3.603839 1.481738
H 0.421652 4.187537 2.126765
H 1.084146 4.897530 0.611175
H 1.176111 -0.715849 2.514565
H -0.432918 -3.804145 -1.908136
H 0.793438 -2.146493 -3.334653
H -1.167413 -4.574016 0.314190
H -0.049413 -2.363995 3.883952
H -2.991615 3.309885 -1.858977
H -1.335647 0.740626 1.217392
H -1.235755 -4.302393 2.804697
H -4.521335 1.464005 -2.586833
H -2.849146 -1.118650 0.487959
H -4.457195 -0.760268 -1.416032


