%chk=000227152.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227152

0 1
 O    6.053100       1.134100      1.2000001E-03
 O    4.611100       2.789300      3.0000001E-04
 N  -0.5963000       1.430200      6.0000003E-04
 N    4.874200       1.562700      3.9999999E-04
 C    1.747400      -1.244800     -6.0000003E-04
 C    1.486100      0.1378000      9.9999997E-05
 C   0.4925000      -1.966800     -1.9999999E-04
 C  -0.5694000      -1.045800      6.9999998E-04
 C   2.1800000E-02  0.3014000      7.9999998E-04
 C    2.486000       1.090700     -9.9999997E-05
 C    3.055400      -1.697400     -1.1000000E-03
 C   0.2223000      -3.324100     -3.9999999E-04
 C   -1.897300      -1.424500      1.1000000E-03
 C    3.803000      0.6295000     -1.0000000E-03
 C    4.085200     -0.7494000     -1.4000000E-03
 C   -1.116700      -3.733700      9.9999997E-05
 C   -2.164800      -2.793600      7.9999998E-04
 C   -2.001300       1.360400      3.9999999E-04
 C   -2.689800       1.326200       1.208100    
 C   -2.689200       1.327100      -1.207800    
 C   -4.779300       1.224300     -3.0000001E-04
 C   -4.083000       1.257900       1.207800    
 C   -4.082300       1.258900      -1.208100    
 C   -6.268700       1.149700     -1.4000000E-03
 H    2.230700       2.144700      6.9999998E-04
 H    3.290500      -2.756500     -1.4000000E-03
 H    1.016900      -4.062600     -1.1000000E-03
 H   -2.782400     -0.8308000      1.5000000E-03
 H    5.108000      -1.120300     -1.6000000E-03
 H   -1.352500      -4.794900     -1.9999999E-04
 H   -3.193700      -3.144600      1.0000000E-03
 H   -2.155300       1.353300       2.153900    
 H   -2.154300       1.355000      -2.153400    
 H   -4.614300       1.229200       2.155400    
 H   -4.613400       1.231000      -2.155900    
 H   -6.592100      0.1041000     -1.1300000E-02
 H   -6.689900       1.638800      0.8835000    
 H   -6.688800       1.655700     -0.8772000    


%chk=000227152-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227152

0 1
O 5.994121 1.432998 0.000149
O 4.322433 2.986102 -0.000118
N -0.705204 1.149646 0.000258
N 4.743841 1.764793 0.000021
C 1.868627 -1.395157 -0.000115
C 1.444706 -0.030946 0.000005
C 0.665610 -2.252918 -0.000168
C -0.498387 -1.416598 -0.000044
C -0.050837 0.019592 0.000158
C 2.361340 1.025823 0.000035
C 3.242316 -1.713036 -0.000196
C 0.544510 -3.654688 -0.000329
C -1.787209 -1.984569 -0.000080
C 3.734674 0.680437 -0.000030
C 4.185099 -0.662432 -0.000146
C -0.753780 -4.222679 -0.000364
C -1.905138 -3.397653 -0.000237
C -2.127627 1.251186 0.000131
C -2.838737 1.361552 1.224045
C -2.838543 1.361245 -1.223998
C -4.966196 1.643056 -0.000193
C -4.236945 1.550778 1.213651
C -4.236676 1.550480 -1.213936
C -6.474270 1.825065 -0.000566
H 2.041662 2.070529 0.000132
H 3.585319 -2.752361 -0.000310
H 1.429202 -4.300315 -0.000435
H -2.680958 -1.355819 0.000039
H 5.261041 -0.855201 -0.000188
H -0.869871 -5.311877 -0.000493
H -2.899476 -3.856413 -0.000251
H -2.290394 1.309495 2.170390
H -2.289985 1.308944 -2.170209
H -4.768831 1.633901 2.169450
H -4.768396 1.633364 -2.169863
H -6.997819 0.848923 -0.010484
H -6.816115 2.370164 0.896906
H -6.813707 2.386791 -0.888718


