%chk=000063995.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063995

0 1
 O  -9.0400003E-02  -1.998000     -0.2576000    
 N  -0.6392000      0.2951000     -0.2408000    
 N   -2.852300      5.5599999E-02  0.7780000    
 N    1.114200       1.909800     -0.2234000    
 N   -4.149200     -0.1412000      0.4856000    
 C   -2.042600      9.7300000E-02 -0.3175000    
 C    1.658400     -0.4746000     -4.4799998E-02
 C   0.2192000     -0.8135000     -0.1663000    
 C    2.044700      0.8695000     -9.0700001E-02
 C  -0.1375000       1.586900     -0.2809000    
 C   -2.863600     -8.5000001E-02  -1.401700    
 C    2.615300      -1.486800      9.6299998E-02
 C    3.404400       1.187200      7.4999998E-03
 C   -2.457800      0.1980000       2.160900    
 C   -4.149900     -0.2262000     -0.8474000    
 C    3.965900      -1.154600      0.1938000    
 C    4.360600      0.1806000      0.1489000    
 H  -0.9070000       2.371000     -0.3716000    
 H   -2.576300     -0.1122000      -2.442700    
 H    2.329900      -2.534500      0.1323000    
 H    3.727500       2.225100     -2.4300000E-02
 H   -2.044000       1.199800       2.298900    
 H   -3.329500      6.3500002E-02   2.806700    
 H   -1.709200     -0.5650000       2.388100    
 H   -5.087600     -0.3878000      -1.359400    
 H    4.710700      -1.937400      0.3039000    
 H    5.412800      0.4388000      0.2246000    


%chk=000063995-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000063995

0 1
O -0.269939 -1.830808 0.533361
N -0.638279 0.373295 -0.213354
N -2.853612 -0.117477 0.789013
N 1.175674 1.913945 -0.670097
N -4.192595 -0.195091 0.425585
C -2.050287 0.182072 -0.302089
C 1.658113 -0.393337 0.129852
C 0.220470 -0.720041 0.183804
C 2.091705 0.904934 -0.298351
C -0.103302 1.617608 -0.613739
C -2.892456 0.325017 -1.418589
C 2.615230 -1.378407 0.489687
C 3.481760 1.193421 -0.353558
C -2.462019 -0.388773 2.175036
C -4.202119 0.081373 -0.916395
C 3.986278 -1.079553 0.429309
C 4.417981 0.209874 0.007260
H -0.851074 2.369101 -0.886387
H -2.591626 0.542496 -2.440709
H 2.253766 -2.361490 0.808129
H 3.787772 2.190800 -0.682569
H -1.786896 0.401351 2.547005
H -3.382324 -0.399930 2.775994
H -1.948854 -1.362229 2.239532
H -5.150117 0.085235 -1.450327
H 4.725489 -1.838245 0.706304
H 5.488762 0.436261 -0.037305


