%chk=000095806.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095806

0 1
 O    5.447200       1.028000     -0.1027000    
 O    4.663600      -1.098600      3.6200002E-02
 N   0.6827000      0.4401000      4.6000000E-02
 N   -2.086400       1.782700      1.9700000E-02
 N  -0.6035000      -1.582800      2.2000000E-03
 N   -4.012500      0.6618000     -2.3000000E-02
 N   -3.042800      -1.567500     -3.4600001E-02
 C    1.944400     -0.2399000      5.7200000E-02
 C   -1.745500      0.4601000      9.1000004E-03
 C  -0.5505000     -0.2320000      1.9200001E-02
 C    3.091000      0.7639000      2.0800000E-02
 C   -2.958200     -0.2154000     -1.7500000E-02
 C   -3.454300       1.853200     -3.0000001E-04
 C    4.453600      0.1055000     -8.9999996E-03
 C   -1.828900      -2.159100     -2.3300000E-02
 H    2.029600     -0.8624000      0.9564000    
 H    2.020000     -0.9086000     -0.8093000    
 H   0.6623000       1.453700      6.4099997E-02
 H    3.046300       1.411200      0.9045000    
 H    3.000900       1.392900     -0.8729000    
 H   -1.449300       2.568000      3.9000001E-02
 H   -3.976800       2.799100      3.1000001E-03
 H   -1.834900      -3.243800     -3.6200002E-02
 H    6.333700      0.6088000     -0.1264000    


%chk=000095806-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095806

0 1
O 5.529027 0.965022 -0.064156
O 4.684981 -1.196827 0.061006
N 0.698150 0.501042 0.026128
N -2.210575 1.875852 0.025822
N -0.537878 -1.506336 -0.005872
N -4.115321 0.605169 -0.000500
N -2.994038 -1.612612 -0.021932
C 1.967235 -0.249998 0.029146
C -1.782853 0.538656 0.012438
C -0.527031 -0.137915 0.011675
C 3.141272 0.741321 -0.008128
C -2.985182 -0.240583 -0.004205
C -3.612051 1.846665 0.017241
C 4.483141 0.033593 0.002348
C -1.750145 -2.155020 -0.022193
H 2.027130 -0.894680 0.924675
H 2.000978 -0.932301 -0.838598
H 0.732242 1.518742 0.055133
H 3.117388 1.427073 0.862239
H 3.101832 1.379932 -0.912216
H -1.637210 2.717621 0.038381
H -4.207107 2.757837 0.024541
H -1.693240 -3.247551 -0.036333
H 6.400955 0.484199 -0.054340


