%chk=000048480.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048480

0 1
 O   -2.976800      -1.779000     -2.9000000E-03
 O   0.3781000      0.4148000      -2.389100    
 O   0.4045000      0.4096000       2.404600    
 O   -1.549400       3.799800      2.2000000E-02
 N  -0.6074000       2.070600      -1.156500    
 N  -0.5971000       2.066600       1.186600    
 C   0.2814000      7.6899998E-02  8.1000002E-03
 C  -0.6935000      -1.108900      1.1700000E-02
 C    1.687700     -0.4536000     -9.9999997E-05
 C   4.2199999E-02  0.8564000      -1.288200    
 C   5.5700000E-02  0.8532000       1.308500    
 C   -2.132300     -0.6366000     -2.7600000E-02
 C    2.754700      0.4324000     -7.9599999E-02
 C    1.904500      -1.823800      7.1500003E-02
 C  -0.9643000       2.715200      1.7700000E-02
 C    4.059900     -5.9799999E-02 -8.7499999E-02
 C    3.209500      -2.316200      6.3600004E-02
 C    4.287200      -1.434100     -1.5900001E-02
 C   -4.350000      -1.414000     -3.7599999E-02
 C   -5.194800      -2.669800     -9.1000004E-03
 H  -0.5948000      -1.728100      0.9149000    
 H  -0.5552000      -1.766900     -0.8584000    
 H   -2.374600     -1.3900000E-02  0.8394000    
 H   -2.346400     -7.4800000E-02 -0.9425000    
 H  -0.8219000       2.561200      -2.020200    
 H  -0.8035000       2.554600       2.053800    
 H    2.595200       1.505900     -0.1329000    
 H    1.135300      -2.582100      0.1409000    
 H    4.899100      0.6269000     -0.1485000    
 H    3.388600      -3.386100      0.1207000    
 H    5.303300      -1.817400     -2.1500001E-02
 H   -4.590200     -0.7891000      0.8299000    
 H   -4.561200     -0.8490000     -0.9525000    
 H   -6.260400      -2.425000     -3.4499999E-02
 H   -4.959400      -3.312500     -0.8639000    
 H   -4.987900      -3.253400      0.8941000    


%chk=000048480-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000048480

0 1
O -3.169075 -1.925202 -0.004471
O -0.203772 0.315440 -2.439799
O -0.208150 0.310428 2.422439
O -0.107773 4.269717 -0.004367
N -0.092905 2.253560 -1.188073
N -0.083455 2.251828 1.176358
C 0.105019 0.032067 -0.008803
C -0.906632 -1.147639 -0.009242
C 1.592091 -0.449129 -0.005067
C -0.086441 0.848926 -1.310019
C -0.084724 0.846900 1.294784
C -2.373810 -0.697763 -0.022031
C 2.635277 0.513213 -0.044052
C 1.930180 -1.822105 0.042943
C -0.087615 3.014267 -0.005063
C 3.987301 0.111531 -0.036608
C 3.285194 -2.223628 0.050258
C 4.318586 -1.261706 0.010690
C -4.616885 -1.660683 -0.016089
C -5.331415 -3.011022 0.002348
H -0.741492 -1.755543 0.896110
H -0.725741 -1.769491 -0.902026
H -2.612465 -0.077912 0.872297
H -2.606372 -0.107632 -0.937363
H -0.145533 2.792446 -2.059382
H -0.128879 2.789179 2.048957
H 2.405875 1.584703 -0.082332
H 1.150750 -2.587413 0.074400
H 4.778489 0.868511 -0.067949
H 3.530514 -3.290681 0.087107
H 5.367630 -1.577025 0.016430
H -4.892241 -1.050252 0.873128
H -4.883195 -1.079682 -0.927506
H -6.427392 -2.868791 -0.005902
H -5.047716 -3.609375 -0.880608
H -5.057426 -3.580042 0.907504


