%chk=000100430.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100430

0 1
 S    2.270500       1.404000     -9.9999997E-05
 N  -0.6626000      -1.221500      3.0000001E-04
 N  -0.6021000       1.177300      1.9999999E-04
 N   -2.709700      3.0500000E-02  3.9999999E-04
 N   -2.737300      -2.314400     -6.9999998E-04
 N   -2.618700       2.373600     -6.0000003E-04
 C    1.405000     -7.3600002E-02   0.000000    
 C  -3.8400002E-02 -3.7000000E-02  1.9999999E-04
 C    2.245600      -1.165000       0.000000    
 C    3.618200     -0.7831000     -9.9999997E-05
 C   -2.000800      -1.109900      1.9999999E-04
 C   -1.944100       1.133600      1.9999999E-04
 C    3.774500      0.5854000     -9.9999997E-05
 H    1.907700      -2.194000       0.000000    
 H    4.448800      -1.476900     -9.9999997E-05
 H    4.700000       1.143800     -9.9999997E-05
 H   -3.747300      -2.279400     -3.9999999E-04
 H   -2.245800      -3.197400     -5.0000002E-04
 H   -2.083200       3.230800     -1.0000000E-03
 H   -3.629200       2.389900     -8.9999998E-04


%chk=000100430-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100430

0 1
S 2.364397 1.501035 -0.000127
N -0.679361 -1.231563 -0.000094
N -0.642430 1.205562 -0.000240
N -2.783969 0.023296 -0.000231
N -2.753587 -2.318082 -0.000221
N -2.676749 2.364376 -0.000409
C 1.428538 -0.042838 -0.000073
C -0.030319 -0.022049 -0.000122
C 2.274754 -1.150182 0.000008
C 3.669565 -0.805653 0.000037
C -2.054019 -1.139707 -0.000137
C -2.019362 1.162746 -0.000253
C 3.890538 0.567709 -0.000020
H 1.878541 -2.167255 0.000044
H 4.477917 -1.540749 0.000101
H 4.840942 1.099791 -0.000015
H -3.769864 -2.292538 -0.000267
H -2.239715 -3.195147 -0.000136
H -2.131409 3.222457 -0.000455
H -3.693309 2.375492 -0.000487


