%chk=000125119.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125119

0 1
 N    3.019100      0.1703000     -0.2872000    
 N   -1.657400       2.528200     -0.2841000    
 N   -1.361300      -2.699100     -0.2858000    
 C    1.366400       1.425300      -1.104100    
 C   0.5509000      -1.896000      -1.105300    
 C   -1.918300      0.4707000      -1.104200    
 C   0.1610000       1.881000      -1.866300    
 C    1.547500      -1.079900      -1.868500    
 C   -1.710000     -0.8004000      -1.867600    
 C    1.934300      0.1592000      -1.128400    
 C   -1.105400       1.595400      -1.126600    
 C  -0.8295000      -1.754600      -1.128100    
 C    2.147200       2.217100     -0.1974000    
 C   0.8472000      -2.967300     -0.1981000    
 C   -2.994900      0.7501000     -0.1978000    
 C    3.168100       1.404800      0.2954000    
 C   -2.801500       2.039400      0.2972000    
 C  -0.3661000      -3.444900      0.2965000    
 C    2.075800       3.552700      0.2538000    
 C    2.040000      -3.572500      0.2527000    
 C   -4.116400      2.0400001E-02  0.2515000    
 C    4.121900       1.857000       1.214400    
 C   -3.670100       2.638300       1.216800    
 C  -0.4503000      -4.495900       1.216700    
 C    3.021900       4.020200       1.173000    
 C    1.973000      -4.624300       1.173300    
 C   -4.994600      0.6047000       1.171000    
 C    4.029400       3.182900       1.644800    
 C   -4.772800       1.894900       1.645400    
 C   0.7447000      -5.077700       1.647100    
 H   0.2372000       2.955800      -2.074100    
 H    1.139800     -0.8147000      -2.851200    
 H   0.1351000       1.396500      -2.849600    
 H    2.440000      -1.683400      -2.077600    
 H   -2.678800      -1.271700      -2.076000    
 H   -1.277200     -0.5797000      -2.850500    
 H    3.619400     -0.6234000     -0.1112000    
 H   -1.270000       3.444600     -0.1066000    
 H   -2.348700      -2.821900     -0.1084000    
 H    1.295900       4.219700     -0.1025000    
 H    3.007200      -3.230900     -0.1050000    
 H   -4.304400     -0.9878000     -0.1067000    
 H    4.906500       1.204400       1.582700    
 H   -3.496900       3.643400       1.586900    
 H   -1.407300      -4.848800       1.586400    
 H    2.967900       5.048100       1.521500    
 H    2.890600      -5.090800       1.521600    
 H   -5.858200      4.3800000E-02   1.518000    
 H    4.754700       3.564800       2.358600    
 H   -5.466400       2.331100       2.359600    
 H   0.7137000      -5.895800       2.362000    


%chk=000125119-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125119

0 1
N 3.027454 0.125673 -0.265190
N -1.621624 2.549455 -0.251290
N -1.410376 -2.678835 -0.273230
C 1.403654 1.440974 -1.178469
C 0.542303 -1.932848 -1.184872
C -1.949881 0.495499 -1.186188
C 0.168102 1.885484 -1.937471
C 1.545276 -1.085158 -1.943757
C -1.712573 -0.790480 -1.955221
C 1.962294 0.156632 -1.183356
C -1.116552 1.621063 -1.179584
C -0.849291 -1.775961 -1.194415
C 2.158139 2.234398 -0.226237
C 0.851109 -2.976227 -0.225067
C -3.012639 0.741399 -0.229660
C 3.171683 1.378784 0.338232
C -2.777728 2.040715 0.349079
C -0.397767 -3.424749 0.338185
C 2.090770 3.587606 0.200576
C 2.056822 -3.586198 0.213070
C -4.148264 0.000119 0.192552
C 4.092696 1.834350 1.304871
C -3.629331 2.597376 1.326604
C -0.464673 -4.440707 1.314773
C 3.008394 4.049694 1.164910
C 1.997329 -4.601876 1.187920
C -5.003592 0.550534 1.167687
C 3.997121 3.181037 1.714207
C -4.744708 1.834423 1.731884
C 0.749644 -5.022531 1.735857
H 0.243117 2.964532 -2.177275
H 1.119855 -0.771702 -2.914999
H 0.111477 1.363142 -2.910280
H 2.440697 -1.690345 -2.187698
H -2.682283 -1.262273 -2.209590
H -1.220817 -0.570249 -2.920521
H 3.563669 -0.709040 -0.036270
H -1.166374 3.428235 -0.012049
H -2.401290 -2.722908 -0.043523
H 1.349488 4.275643 -0.226368
H 3.024232 -3.288400 -0.211945
H -4.374278 -0.980966 -0.245151
H 4.857038 1.172470 1.727434
H -3.437417 3.584997 1.760912
H -1.420733 -4.770203 1.736951
H 2.969073 5.092458 1.499443
H 2.920225 -5.081976 1.532278
H -5.884535 -0.010265 1.499749
H 4.695532 3.567880 2.464567
H -5.425485 2.235209 2.491098
H 0.734919 -5.812584 2.494837


