%chk=000128049.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128049

0 1
 O   -4.674900     -0.1366000     -3.9999999E-04
 N   -1.264100     -0.6447000      6.0000003E-04
 N  -0.3205000       1.509000     -9.9999997E-05
 N   -2.692800       1.091800     -5.0000002E-04
 C  -1.1600000E-02  -1.363800       0.000000    
 C    1.171700     -0.4228000       0.000000    
 C   -1.436900      0.7159000     -1.9999999E-04
 C   0.9803000      0.9743000      1.9999999E-04
 C   -2.545500      -1.304000      6.9999998E-04
 C    2.471900     -0.9451000     -9.9999997E-05
 C   -3.452300     -7.4699998E-02   0.000000    
 C    2.095900       1.821200      1.9999999E-04
 C    3.573800     -9.0599999E-02 -9.9999997E-05
 C    3.386200       1.289800      9.9999997E-05
 C    2.718600      -2.419700     -6.0000003E-04
 H   2.8500000E-02  -1.999000     -0.8919000    
 H   2.8999999E-02  -1.999700      0.8914000    
 H   -2.705200      -1.890300      0.9087000    
 H   -2.705000      -1.891100     -0.9066000    
 H  -0.4099000       2.518700     -9.9999997E-05
 H    1.967400       2.900900      1.9999999E-04
 H    4.587200     -0.4836000     -1.9999999E-04
 H    4.245400       1.954300       0.000000    
 H    2.288000      -2.882000     -0.8947000    
 H    3.788800      -2.654300     -6.0000003E-04
 H    2.287900      -2.882600      0.8932000    


%chk=000128049-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128049

0 1
O -4.775782 -0.038581 0.000706
N -1.264981 -0.681328 0.000416
N -0.318146 1.493569 -0.000132
N -2.693910 1.150801 0.000172
C 0.011186 -1.402491 -0.000364
C 1.198860 -0.440232 -0.000151
C -1.427291 0.689442 0.000104
C 0.998542 0.968944 -0.000100
C -2.602948 -1.283733 0.000416
C 2.523659 -0.955393 -0.000142
C -3.521997 -0.003094 0.000159
C 2.100612 1.857476 -0.000023
C 3.620145 -0.057537 -0.000082
C 3.409280 1.338797 -0.000027
C 2.765777 -2.454726 -0.000228
H 0.062964 -2.068949 -0.889421
H 0.063429 -2.069898 0.887924
H -2.794939 -1.896312 0.901175
H -2.794818 -1.896550 -0.900216
H -0.479768 2.500651 -0.000199
H 1.929908 2.940267 0.000034
H 4.639754 -0.457749 -0.000084
H 4.264159 2.023182 0.000028
H 2.321667 -2.942662 -0.889666
H 3.844975 -2.679801 -0.000179
H 2.321560 -2.942793 0.889081


