%chk=000029296.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029296

0 1
 N   -1.035000      0.8198000     -0.6743000    
 N    2.443300      -1.409300      1.8700000E-02
 N   -4.528200       1.140100      0.4763000    
 C    1.392500      0.7081000     -0.4839000    
 C    1.477000       2.179800     -0.7814000    
 C    2.066800       2.990800      0.3726000    
 C    3.590700       2.922300      0.4643000    
 C    4.153300       1.541000      0.7967000    
 C    3.907500      0.4979000     -0.2920000    
 C    2.517400     -7.9099998E-02 -0.2534000    
 C   0.1492000      7.2200000E-02 -0.4332000    
 C   5.0600000E-02  -1.296700     -0.1554000    
 C    1.240900      -2.009200      6.8099998E-02
 C   -2.321100      0.3745000     -0.2540000    
 C   -3.198200       1.576900      7.0299998E-02
 C   -1.191500      -1.952500     -9.7800002E-02
 C    1.149300      -3.370500      0.3454000    
 C   -1.256600      -3.314500      0.1810000    
 C  -8.3600000E-02  -4.024700      0.4031000    
 C   -5.154100      0.3424000     -0.5801000    
 C   -5.370100       2.290700      0.8091000    
 H    2.073400       2.320700      -1.692300    
 H   0.5134000       2.635200      -1.013000    
 H    1.798300       4.044100      0.2200000    
 H    1.617800       2.689700       1.327300    
 H    4.032000       3.283200     -0.4731000    
 H    3.916800       3.620200       1.245600    
 H    3.759400       1.196900       1.761100    
 H    5.238000       1.651200      0.9219000    
 H    4.625300     -0.3202000     -0.1475000    
 H    4.112200      0.9074000      -1.288400    
 H  -0.9907000       1.591500      -1.326700    
 H   -2.780600     -0.1278000      -1.108400    
 H   -2.309700     -0.1520000      0.7072000    
 H   -2.730000       2.149600      0.8823000    
 H   -3.249000       2.251200     -0.7962000    
 H   -2.161100      -1.668000     -0.4435000    
 H    2.054700      -3.948900      0.5204000    
 H   -2.211100      -3.833400      0.1811000    
 H  -0.1228000      -5.090000      0.6108000    
 H   -4.721300     -0.6607000     -0.6461000    
 H   -5.106300      0.8294000      -1.560900    
 H   -6.213100      0.1707000     -0.3499000    
 H   -6.348900       1.960000       1.174100    
 H   -5.526700       2.951200     -5.1399998E-02
 H   -4.918200       2.877300       1.616900    


%chk=000029296-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000029296

0 1
N -1.108650 0.347661 -1.087868
N 2.525709 -1.402282 0.351553
N -4.424727 1.407770 0.418106
C 1.309572 0.484305 -0.672262
C 1.395435 1.930764 -1.144245
C 1.614781 2.966532 0.001150
C 3.092354 3.103853 0.440264
C 3.746679 1.813487 0.988229
C 3.797288 0.630527 -0.021618
C 2.490275 -0.141188 -0.139626
C 0.089902 -0.250566 -0.671723
C 0.124094 -1.647715 -0.267652
C 1.366265 -2.158947 0.271576
C -2.440395 0.158210 -0.474795
C -3.031422 1.528375 -0.056149
C -0.968354 -2.561106 -0.435831
C 1.433513 -3.519155 0.714889
C -0.866686 -3.893575 -0.023757
C 0.336235 -4.372505 0.580819
C -5.409482 1.291736 -0.676414
C -4.802860 2.450767 1.393444
H 2.228942 2.030551 -1.868942
H 0.493624 2.226404 -1.713377
H 1.264043 3.959982 -0.344019
H 0.984453 2.686547 0.868326
H 3.684519 3.456009 -0.431092
H 3.165438 3.899210 1.209335
H 3.223700 1.480729 1.906488
H 4.785162 2.056399 1.288811
H 4.555040 -0.100593 0.307075
H 4.116464 1.018677 -1.011400
H -1.003962 1.247467 -1.560145
H -3.136567 -0.349984 -1.172341
H -2.353520 -0.474025 0.423052
H -2.411172 1.935886 0.763824
H -2.943696 2.247783 -0.916551
H -1.882622 -2.230087 -0.934959
H 2.384959 -3.858035 1.136665
H -1.709360 -4.576949 -0.176662
H 0.402461 -5.414236 0.914184
H -5.143875 0.457316 -1.347476
H -5.485891 2.222253 -1.295538
H -6.407769 1.077688 -0.255226
H -5.813396 2.237649 1.786203
H -4.814956 3.484160 0.962459
H -4.099644 2.440746 2.244620


