%chk=000031921.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031921

0 1
 N    1.207900     -0.8486000      1.3000000E-03
 N   -1.485400     -0.3845000     -0.8983000    
 N    4.254300      0.9539000      5.1399998E-02
 C   0.7119000      -1.569600      -1.181000    
 C   0.1291000     -0.7346000      0.9946000    
 C   0.2239000      -2.993700     -0.8412000    
 C  -0.3919000      -2.110900       1.459400    
 C  -0.3906000     -0.6962000      -1.826100    
 C  -0.9799000      0.1478000      0.3735000    
 C  -0.7751000      -3.048200      0.3144000    
 C    2.447900      -1.391900      0.5419000    
 C   -2.456000      0.5209000      -1.505900    
 C    2.993900     -0.4730000       1.636300    
 C    3.281500      0.9447000       1.137200    
 C   -3.646600      0.7481000     -0.6128000    
 C   -4.747500     -9.0999998E-02 -0.7150000    
 C   -3.626500       1.793000      0.3004000    
 C    5.524400      0.3740000      0.4921000    
 C    4.463000       2.316200     -0.4427000    
 C   -5.850500      0.1192000      0.1125000    
 C   -4.729600       2.003100       1.128000    
 C    6.526700      0.3166000     -0.6482000    
 C    3.156500       2.938400     -0.9059000    
 C   -5.841500       1.166100       1.034000    
 H    1.518500      -1.652200      -1.921300    
 H   0.4461000     -0.1803000       1.882400    
 H  -0.2229000      -3.458600      -1.728400    
 H    1.090000      -3.615600     -0.5813000    
 H   0.3763000      -2.600500       2.070600    
 H   -1.257600      -1.979600       2.120200    
 H  -0.7912000      -1.223100      -2.701000    
 H   6.7599997E-02  0.2329000      -2.194300    
 H  -0.5827000       1.163300      0.2345000    
 H   -1.775600      0.1969000       1.123600    
 H   -1.777300      -2.796700     -5.0299998E-02
 H  -0.8508000      -4.076000      0.6887000    
 H    2.319200      -2.397200      0.9576000    
 H    3.192400      -1.488600     -0.2572000    
 H   -2.812000      0.1026000      -2.457000    
 H   -1.997500       1.486300      -1.762100    
 H    2.316200     -0.4170000       2.494800    
 H    3.885700     -0.9340000       2.074600    
 H    2.323100       1.377600      0.8369000    
 H    3.639800       1.546700       1.983300    
 H   -4.764000     -0.9110000      -1.427300    
 H   -2.773800       2.461800      0.3762000    
 H    5.400000     -0.6666000      0.8031000    
 H    5.955300      0.9232000       1.338700    
 H    4.929600       2.960200      0.3133000    
 H    5.115300       2.310500      -1.321900    
 H   -6.716100     -0.5328000      3.9799999E-02
 H   -4.724000       2.820200       1.843500    
 H    7.371000     -0.3214000     -0.3629000    
 H    6.947000       1.298500     -0.8865000    
 H    6.086400     -0.1126000      -1.554800    
 H    2.528300       3.266000     -7.1699999E-02
 H    2.581600       2.256200      -1.541900    
 H    3.369500       3.833900      -1.500900    
 H   -6.700600       1.330100       1.678000    


%chk=000031921-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000031921

0 1
N 1.127256 -0.682038 0.178197
N -1.551607 0.073892 -0.615409
N 4.657129 0.837878 0.147566
C 0.643499 -1.019564 -1.193227
C -0.006451 -0.850206 1.137794
C 0.165542 -2.499706 -1.296507
C -0.542068 -2.315566 1.166385
C -0.427666 0.027098 -1.583620
C -1.074440 0.209975 0.783688
C -0.915565 -2.853708 -0.241146
C 2.414504 -1.305498 0.571224
C -2.545308 1.109082 -0.977181
C 3.145572 -0.498483 1.668209
C 3.580997 0.898661 1.175895
C -3.871770 0.968242 -0.235881
C -4.467812 -0.305900 -0.054293
C -4.555341 2.113685 0.240519
C 6.005600 0.672248 0.753574
C 4.588952 1.970207 -0.816631
C -5.720924 -0.430209 0.584263
C -5.812769 1.994213 0.877152
C 7.030706 0.044366 -0.210719
C 3.478964 1.784501 -1.869109
C -6.400731 0.720523 1.050617
H 1.493240 -0.876198 -1.889235
H 0.361223 -0.596210 2.150938
H -0.216519 -2.703152 -2.316613
H 1.052069 -3.151380 -1.154061
H 0.242834 -2.960899 1.611745
H -1.417985 -2.376562 1.841901
H -0.838233 -0.210501 -2.584681
H 0.089942 1.019410 -1.652020
H -0.616036 1.218766 0.951137
H -1.943615 0.114975 1.460175
H -1.873734 -2.403648 -0.550610
H -1.053367 -3.952529 -0.198027
H 2.304216 -2.363870 0.910000
H 3.067961 -1.313268 -0.322093
H -2.728957 1.013430 -2.067276
H -2.144153 2.143755 -0.814050
H 2.493651 -0.378401 2.557101
H 4.027077 -1.080765 2.003686
H 2.691356 1.375526 0.727800
H 3.891590 1.528849 2.046864
H -3.929351 -1.191477 -0.410296
H -4.100035 3.104436 0.115151
H 5.898317 0.007927 1.631417
H 6.400047 1.646212 1.143966
H 4.447308 2.946008 -0.285273
H 5.561978 2.037541 -1.337283
H -6.169355 -1.421676 0.717706
H -6.328238 2.890677 1.240619
H 8.007274 -0.085621 0.292634
H 7.196737 0.673746 -1.103693
H 6.673720 -0.942493 -0.553854
H 2.489085 1.659047 -1.394201
H 3.679878 0.882478 -2.474402
H 3.430278 2.660536 -2.543394
H -7.373772 0.624535 1.545762


