%chk=000143679.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000143679

0 1
 O    5.359200       1.100800      0.4289000    
 O    5.361700      -1.094400      0.4301000    
 N  -0.7614000     -2.0999999E-03 -0.6714000    
 N    4.761900      2.4000001E-03  0.3222000    
 C   0.6216000     -1.9000000E-03 -0.4219000    
 C    1.303800       1.206700     -0.2985000    
 C    1.306200      -1.209100     -0.2991000    
 C    2.676500       1.208100     -5.1300000E-02
 C    2.679000      -1.207900     -5.1800001E-02
 C    3.364200      6.9999998E-04  7.1999997E-02
 C   0.5904000       2.513100     -0.4265000    
 C   0.5963000      -2.517200     -0.4294000    
 C   -2.994600     -1.8000000E-03  0.2702000    
 C   -1.543800     -2.6000000E-03  0.3728000    
 C   -3.776500     -3.7000000E-03   1.425300    
 C   -3.604000      2.3000001E-03 -0.9845000    
 C   -5.167800     -1.2000001E-03   1.325700    
 C   -4.995300      4.8000002E-03  -1.084000    
 C   -5.777300      3.0000000E-03  7.1099997E-02
 H    3.193000       2.160500      4.3499999E-02
 H    3.197500      -2.159300      4.2300001E-02
 H  -7.5400002E-02   2.668600      0.4285000    
 H    1.288100       3.356900     -0.4614000    
 H   4.8000002E-03   2.546000      -1.351500    
 H    1.296000      -3.359500     -0.4629000    
 H  -7.1199998E-02  -2.674600      0.4240000    
 H   1.2800000E-02  -2.550900      -1.355600    
 H   -1.115600     -3.5000001E-03   1.393100    
 H   -3.316200     -6.6000000E-03   2.410000    
 H   -3.020500      4.1000000E-03  -1.901300    
 H   -5.776800     -2.4000001E-03   2.225000    
 H   -5.470300      8.1000002E-03  -2.060800    
 H   -6.860600      4.9999999E-03 -6.3999998E-03


%chk=000143679-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000143679

0 1
O 5.537247 1.141671 0.053129
O 5.537542 -1.140454 0.051537
N -0.736881 0.000160 -0.405118
N 4.925284 0.000556 0.015031
C 0.663591 0.000163 -0.229037
C 1.364867 1.250184 -0.198712
C 1.365192 -1.249726 -0.200425
C 2.769484 1.233717 -0.117910
C 2.769805 -1.232984 -0.119623
C 3.455648 0.000426 -0.073885
C 0.597793 2.555656 -0.263940
C 0.598516 -2.555343 -0.267567
C -3.068712 -0.001181 0.313457
C -1.614497 -0.001577 0.558434
C -3.957316 -0.002759 1.422200
C -3.597338 0.000753 -1.007404
C -5.353402 -0.002434 1.217103
C -4.990355 0.001074 -1.209561
C -5.871945 -0.000513 -0.098698
H 3.344648 2.163307 -0.088949
H 3.345226 -2.162456 -0.091959
H -0.004886 2.724288 0.648724
H 1.282651 3.411909 -0.376695
H -0.109804 2.555080 -1.113795
H 1.283699 -3.411271 -0.380794
H -0.004741 -2.725154 0.644489
H -0.108494 -2.554083 -1.117916
H -1.301710 -0.002964 1.623835
H -3.551781 -0.004243 2.441923
H -2.897668 0.001956 -1.849621
H -6.034109 -0.003661 2.074987
H -5.396221 0.002557 -2.226956
H -6.955630 -0.000256 -0.259883


