%chk=000160218.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160218

-1 1
 O   0.8712000       1.682200      -1.129300    
 O   0.8370000       1.590400       1.136100    
 O   -1.342400      -2.988600      0.1223000    
 N   0.4900000      0.9078000      1.1000000E-02
 N  -0.7428000      -1.692800      1.1900000E-02
 N    3.316800      0.9120000      3.1099999E-02
 C  -0.9869000      0.7414000     -3.0000000E-03
 C    1.266100     -0.3636000     -1.8300001E-02
 C   -1.577700     -0.5364000      6.0999999E-03
 C   0.6599000      -1.576800     -3.8400002E-02
 C   -1.801900       1.891900     -1.6100001E-02
 C   -2.987200     -0.6149000      3.4000000E-03
 C    1.454900      -2.871600     -0.1434000    
 C    2.740300     -0.2299000      6.3999998E-03
 C   -3.189400       1.787900     -1.9200001E-02
 C   -3.782000      0.5334000     -8.8999998E-03
 C    4.774000      0.8276000      4.8200000E-02
 H   -1.351000       2.881700     -2.2000000E-02
 H   -3.500200      -1.573600      6.2000002E-03
 H   0.9450000      -3.608400     -0.7741000    
 H    1.604900      -3.305700      0.8504000    
 H    2.426700      -2.753800     -0.6271000    
 H    3.338800      -1.151100      3.8800001E-02
 H   -3.803700       2.683100     -2.8999999E-02
 H   -4.864400      0.4430000     -1.1900000E-02
 H   0.5846000       1.112700      -1.864800    
 H    5.154800      0.2267000     -0.7850000    
 H    5.132400      0.4104000      0.9951000    
 H    5.191300       1.834100     -5.3100001E-02


%chk=000160218-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160218

-1 1
O -0.600652 0.887846 -2.110237
O 0.988961 2.177174 0.328106
O -1.157012 -2.856499 -0.348681
N 0.571849 0.983741 -0.069027
N -0.604769 -1.616461 -0.300058
N 3.529380 0.933095 0.505011
C -0.865423 0.830438 -0.563431
C 1.349142 -0.160245 -0.041289
C -1.446007 -0.484936 -0.182315
C 0.763635 -1.452889 -0.317668
C -1.728788 1.973264 -0.163818
C -2.807668 -0.641623 0.176017
C 1.568418 -2.704285 -0.572950
C 2.775386 -0.122592 0.283189
C -3.050095 1.790429 0.213890
C -3.629663 0.478563 0.360747
C 4.948501 0.663655 0.802123
H -1.269553 2.962404 -0.238292
H -3.166936 -1.666501 0.311182
H 0.888842 -3.432312 -1.049248
H 1.936840 -3.179011 0.360134
H 2.435255 -2.508273 -1.228421
H 3.220168 -1.142179 0.337949
H -3.667241 2.674791 0.425887
H -4.679320 0.362040 0.653122
H -1.462747 0.586937 -2.505346
H 5.241537 -0.418326 0.800740
H 5.197715 1.087422 1.795543
H 5.579345 1.193433 0.060539


