%chk=000167957.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167957

0 1
 O    1.741200      -1.013500     -0.1708000    
 O   -4.123100       1.012300      0.6648000    
 N   -5.558100       1.238300      0.6001000    
 C    3.915600     -0.1091000      0.2619000    
 C    4.882100       1.040100     -9.9999998E-03
 C    2.598100      7.7699997E-02 -0.4771000    
 C   0.3929000     -0.7679000     -0.1983000    
 C    6.179900      0.8715000      0.7636000    
 C   -2.341700     -0.2693000     -0.2520000    
 C  -0.4540000      -1.488300      0.6359000    
 C  -0.1133000      0.1991000      -1.059200    
 C   -1.826100      -1.238300      0.6088000    
 C   -1.485200      0.4494000      -1.086100    
 C   -3.808400     -1.8000000E-03 -0.2817000    
 H    4.367600      -1.064300     -3.3599999E-02
 H    3.718100     -0.1917000       1.338200    
 H    4.419100       1.992600      0.2730000    
 H    5.104900       1.093300      -1.082100    
 H    2.166700       1.034500     -0.1547000    
 H    2.774700      0.1037000      -1.558700    
 H    5.993900      0.8495000       1.842300    
 H    6.685800     -5.7799999E-02  0.4829000    
 H    6.858000       1.704400      0.5529000    
 H  -5.6200001E-02  -2.243000       1.308400    
 H   0.5152000      0.7602000      -1.743900    
 H   -2.482600      -1.803500       1.265000    
 H   -1.875500       1.203800      -1.764200    
 H   -4.113200      0.3165000      -1.287400    
 H   -4.363500     -0.9195000     -4.6300001E-02
 H   -5.581000       2.242800      0.4313000    
 H   -5.812400       1.101500       1.577100    


%chk=000167957-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167957

0 1
O 1.697010 -0.504742 0.561800
O -4.522361 0.739854 0.530979
N -6.007296 0.800756 0.298011
C 4.056857 0.009007 0.434412
C 5.173907 0.880202 -0.186342
C 2.670857 0.394521 -0.086108
C 0.341674 -0.346552 0.237958
C 6.575760 0.496281 0.333806
C -2.453299 -0.206858 -0.280723
C -0.547711 -1.241994 0.885477
C -0.161463 0.620737 -0.668516
C -1.926760 -1.167225 0.624785
C -1.551326 0.678803 -0.915166
C -3.937244 -0.123525 -0.540031
H 4.241204 -1.058523 0.207208
H 4.068157 0.109497 1.536679
H 4.977521 1.948943 0.036492
H 5.149901 0.780951 -1.290931
H 2.429270 1.448410 0.167091
H 2.612414 0.272900 -1.188497
H 6.637461 0.616435 1.431588
H 6.810543 -0.558603 0.098244
H 7.360899 1.127604 -0.120566
H -0.134109 -1.979585 1.579956
H 0.506519 1.320332 -1.179218
H -2.609266 -1.859687 1.131572
H -1.938571 1.431042 -1.613124
H -4.160944 0.332007 -1.524021
H -4.424827 -1.116402 -0.493248
H -6.202405 1.813858 0.200017
H -6.412871 0.464754 1.190515


