%chk=000077747.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077747

0 1
 O    3.619800      0.1714000     -3.5000001E-03
 O   4.9500000E-02  -2.920900      1.3000000E-03
 N   0.2724000     -0.5602000     -1.9999999E-04
 N    1.294100      0.3601000     -1.8000000E-03
 N   -5.023700       1.244600      1.9999999E-04
 C    2.207500      -1.799000     -6.0000003E-04
 C   0.7054000      -1.892800      1.1000000E-03
 C   -1.048100     -0.1101000       0.000000    
 C    2.385500     -0.3292000     -2.0000001E-03
 C   -2.097800      -1.028600      1.6000000E-03
 C   -1.318600       1.258300     -1.4000000E-03
 C   -3.418100     -0.5787000      1.8000000E-03
 C   -2.639000       1.708300     -1.1000000E-03
 C   -3.688800      0.7897000      5.0000002E-04
 C    3.632300       1.603300     -4.6000001E-03
 C    5.067700       2.083900      8.8000000E-03
 H    2.620100      -2.243400     -0.9079000    
 H    2.622100      -2.242100      0.9063000    
 H   -1.970100      -2.101800      2.7000001E-03
 H  -0.5292000       2.004900     -2.6000000E-03
 H   -4.228400      -1.303400      2.9000000E-03
 H   -2.837400       2.777100     -2.2000000E-03
 H    3.137200       1.981600     -0.9071000    
 H    3.120900       1.984700      0.8875000    
 H    5.114800       3.176500      8.0000004E-03
 H    5.591700       1.708100      0.8938000    
 H    5.608800       1.706100     -0.8650000    
 H   -5.220500       2.236600      1.9999999E-04
 H   -5.785300      0.5792000      2.2000000E-03


%chk=000077747-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077747

0 1
O 3.671960 0.227532 0.000450
O 0.040771 -3.028232 0.000895
N 0.242048 -0.642031 0.000876
N 1.300185 0.341888 0.000752
N -5.102248 1.293396 -0.001373
C 2.259624 -1.835653 0.000727
C 0.722991 -1.965869 0.001579
C -1.107225 -0.167705 0.000272
C 2.428897 -0.344007 0.000780
C -2.201134 -1.073993 0.000454
C -1.361268 1.227748 -0.000486
C -3.519183 -0.584268 -0.000081
C -2.681721 1.710217 -0.001011
C -3.789029 0.814099 -0.000815
C 3.708283 1.726292 0.001028
C 5.178130 2.126650 0.003852
H 2.696310 -2.320116 -0.889455
H 2.697092 -2.320252 0.890436
H -2.010368 -2.149211 0.001040
H -0.516999 1.920862 -0.000655
H -4.352615 -1.297670 0.000075
H -2.859402 2.792822 -0.001590
H 3.168120 2.082366 -0.895767
H 3.164708 2.081897 0.895930
H 5.264565 3.228391 0.003714
H 5.690746 1.738110 0.900101
H 5.694277 1.737633 -0.890166
H -5.292875 2.290584 -0.001657
H -5.889845 0.652722 -0.001005


