%chk=000072497.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072497

0 1
 O   -2.070800      -2.286700      0.8746000    
 N   0.3800000      -1.740600     -0.2025000    
 N  -0.6627000     -0.8874000     -0.3169000    
 N   -5.049200       1.527600     -0.2508000    
 C    2.792100      0.9425000      0.3574000    
 C    1.607600      0.3547000     -0.4078000    
 C    4.091100      0.2465000     -6.4099997E-02
 C    1.533600      -1.150800     -0.2207000    
 C    2.886100       2.424400      0.1546000    
 C    2.805900      -1.924900     -0.1108000    
 C    3.963900      -1.247900     -7.1599998E-02
 C    2.754900       3.270100       1.386300    
 C    2.728200      -3.419000     -7.9099998E-02
 C    3.077100       2.963200      -1.058600    
 C   -1.868100      -1.243100      0.2589000    
 C   -2.980600     -0.2742000      8.0499999E-02
 C   -4.275200     -0.7363000      9.6900001E-02
 C   -2.683000       1.056200     -9.5700003E-02
 C   -5.276100      0.2067000     -7.3399998E-02
 C   -3.755100       1.918900     -0.2574000    
 H    2.636700      0.7331000       1.426300    
 H    1.662500      0.5503000      -1.485700    
 H   0.7356000      0.8786000     -6.3000000E-03
 H    4.888300      0.5259000      0.6368000    
 H    4.427000      0.5548000      -1.061200    
 H    4.898900      -1.801900     -2.9800000E-02
 H    1.783400       3.100500       1.862000    
 H    3.543500       3.021600       2.104100    
 H    2.833600       4.339200       1.162600    
 H    3.720600      -3.879100     -2.5300000E-02
 H    2.236900      -3.797100     -0.9816000    
 H    2.160300      -3.754500      0.7948000    
 H    3.143400       4.038700      -1.188800    
 H    3.170700       2.357000      -1.952800    
 H  -0.5738000     -9.8499998E-02 -0.9465000    
 H   -4.527200      -1.781900      0.2299000    
 H   -1.679800       1.463400     -8.6499996E-02
 H   -6.320900     -8.6000003E-02 -7.2800003E-02
 H   -3.596000       2.983600     -0.3940000    


%chk=000072497-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000072497

0 1
O -2.249716 -2.672711 0.160087
N 0.324641 -1.546975 0.130059
N -0.831914 -0.805746 -0.057570
N -5.568080 1.157385 -0.518865
C 3.001353 1.102179 0.371198
C 1.703558 0.553003 -0.267468
C 4.207667 0.237553 -0.097406
C 1.497764 -0.929156 0.037731
C 3.238934 2.595157 0.128426
C 2.687349 -1.792626 0.188806
C 3.939231 -1.241224 0.086152
C 4.368420 3.215417 0.936687
C 2.473222 -3.275734 0.414448
C 2.504391 3.342950 -0.738832
C -2.087130 -1.433400 0.002189
C -3.255415 -0.488990 -0.172690
C -4.473617 -1.030009 -0.653795
C -3.227214 0.891795 0.154534
C -5.587366 -0.179046 -0.815061
C -4.396321 1.664267 -0.033952
H 2.917656 0.950862 1.469908
H 1.748918 0.689238 -1.368848
H 0.854543 1.166583 0.097241
H 5.119799 0.517029 0.462681
H 4.423897 0.462018 -1.164652
H 4.811974 -1.905137 0.145345
H 4.237132 3.018217 2.018679
H 5.352259 2.794143 0.652712
H 4.417074 4.307245 0.788678
H 3.438324 -3.807943 0.471623
H 1.863503 -3.714933 -0.394736
H 1.908956 -3.454507 1.346946
H 2.708549 4.410445 -0.881136
H 1.685563 2.926365 -1.334779
H -0.795923 0.190263 -0.310449
H -4.531330 -2.098118 -0.882875
H -2.341147 1.368354 0.589579
H -6.539196 -0.567406 -1.193428
H -4.406910 2.730792 0.217833


