%chk=000031907.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031907

0 1
 O    3.071300       2.545100      0.1519000    
 O   0.8415000      -1.664500     -0.1095000    
 O    5.438700      -1.395800     -0.1162000    
 N    4.238600      0.5643000      1.9200001E-02
 N    3.139400      -1.511100     -0.1096000    
 C    1.834500      0.5044000      2.7500000E-02
 C   -3.113500      0.4151000      4.1299999E-02
 C   0.6497000       1.129000      7.5000003E-02
 C    3.076000       1.320200      7.3899999E-02
 C    1.858500     -0.9784000     -6.8899997E-02
 C   -1.795300       1.071400      8.5000001E-02
 C  -0.6154000      0.4329000      3.6699999E-02
 C    4.349400     -0.8216000     -7.1699999E-02
 C   -3.213100     -0.9297000      0.3600000    
 C   -4.228900       1.155200     -0.3167000    
 C   -4.461200      -1.551200      0.3191000    
 C   -5.477100      0.5339000     -0.3574000    
 C   -5.593100     -0.8194000     -3.9500002E-02
 H   0.6009000       2.212600      0.1521000    
 H   -1.816800       2.155000      0.1863000    
 H  -0.7299000     -0.6117000     -0.1429000    
 H    5.112600       1.082400      4.7800001E-02
 H    3.202600      -2.523300     -0.1760000    
 H   -2.371000      -1.536300      0.6773000    
 H   -4.154300       2.209800     -0.5684000    
 H   -4.553700      -2.603000      0.5740000    
 H   -6.358700       1.103500     -0.6365000    
 H   -6.565300      -1.302700     -6.9499999E-02


%chk=000031907-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000031907

0 1
O 2.906407 2.557079 -0.171746
O 1.261358 -2.020752 0.142779
O 5.813243 -1.072533 0.087190
N 4.316777 0.722446 -0.041107
N 3.510205 -1.484755 0.110892
C 1.886661 0.344417 -0.019342
C -3.190726 0.354509 -0.026266
C 0.607919 0.894943 -0.059480
C 3.026817 1.300328 -0.083840
C 2.143774 -1.111478 0.082230
C -1.840318 0.910193 -0.063080
C -0.649657 0.204667 -0.013219
C 4.631989 -0.641757 0.054668
C -3.450526 -1.047487 0.071369
C -4.302031 1.248548 -0.089913
C -4.771903 -1.528128 0.103630
C -5.624395 0.764726 -0.057447
C -5.864396 -0.626435 0.039454
H 0.586889 1.993447 -0.135377
H -1.778542 2.007619 -0.138790
H -0.624449 -0.886236 0.061409
H 5.112177 1.366402 -0.084441
H 3.707008 -2.487823 0.181053
H -2.617357 -1.756099 0.122126
H -4.116092 2.327073 -0.164899
H -4.957801 -2.604829 0.178823
H -6.465186 1.464592 -0.107088
H -6.891443 -1.006576 0.064714


