%chk=000117565.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117565

0 1
 O  -1.9999999E-04  0.5320000     -2.7000001E-03
 O   1.3000000E-03  -4.811600      2.7000001E-03
 N   -2.495100      0.6682000      0.6285000    
 N    2.495200      0.6685000     -0.6292000    
 C   -1.234200      -1.441300      0.3107000    
 C    1.234600      -1.441200     -0.3118000    
 C   -1.234000      -2.837800      0.3112000    
 C    1.234700      -2.837700     -0.3116000    
 C   9.9999997E-05 -0.6920000     -8.9999998E-04
 C   5.0000002E-04  -3.586900      3.0000001E-04
 C   -2.410900     -0.7430000      0.6074000    
 C    2.411300     -0.7430000     -0.6083000    
 C   -2.410500      -3.536000      0.6084000    
 C    2.411400      -3.535900     -0.6085000    
 C   -3.581100      -1.442800      0.9033000    
 C    3.581700      -1.442600     -0.9034000    
 C   -3.580800      -2.836300      0.9036000    
 C    3.581700      -2.836100     -0.9036000    
 C   -3.547400       1.561500      0.3605000    
 C    3.547000       1.561900     -0.3607000    
 C   -4.541800       1.220100     -0.5595000    
 C    4.541100       1.220800      0.5599000    
 C   -3.602800       2.795600       1.013000    
 C    3.602500       2.796100      -1.013100    
 C   -5.584800       2.107200     -0.8256000    
 C    5.583700       2.108200      0.8265000    
 C   -4.645900       3.682800      0.7471000    
 C    4.645300       3.683500     -0.7466000    
 C   -5.636900       3.338600     -0.1721000    
 C    5.635800       3.339500      0.1731000    
 C   -6.645300       1.739200      -1.807100    
 C    6.643700       1.740300       1.808600    
 H   -2.436100      -4.622400      0.6170000    
 H    2.437100      -4.622200     -0.6167000    
 H   -4.505100     -0.9371000       1.169900    
 H    4.505700     -0.9367000      -1.169700    
 H   -1.642900       1.123100      0.9417000    
 H    1.643100       1.123000     -0.9432000    
 H   -4.491200      -3.379200       1.141300    
 H    4.492200      -3.378900      -1.140900    
 H   -4.502900      0.2770000      -1.099300    
 H    4.502200      0.2778000       1.099600    
 H   -2.837200       3.076000       1.732000    
 H    2.837200       3.076400      -1.732500    
 H   -4.686300       4.641600       1.255600    
 H    4.685600       4.642400      -1.255100    
 H   -6.443200       4.039400     -0.3715000    
 H    6.441800       4.040600      0.3730000    
 H   -7.583100       2.264400      -1.596300    
 H   -6.323300       1.994500      -2.821500    
 H   -6.862900      0.6665000      -1.765400    
 H    7.581500       2.266100       1.598600    
 H    6.321000       1.995300       2.822900    
 H    6.861800      0.6677000       1.766700    


%chk=000117565-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000117565

0 1
O -0.000024 0.610348 -0.000885
O 0.000198 -4.918321 0.000228
N -2.559021 0.647069 0.227729
N 2.559471 0.647027 -0.228526
C -1.266299 -1.437773 0.148781
C 1.266684 -1.437777 -0.149285
C -1.267089 -2.872127 0.176269
C 1.267408 -2.872151 -0.176719
C 0.000200 -0.709359 -0.000037
C 0.000123 -3.643179 -0.000418
C -2.534388 -0.738328 0.275410
C 2.534826 -0.738396 -0.276038
C -2.457959 -3.599687 0.361132
C 2.458226 -3.599791 -0.361540
C -3.721359 -1.508589 0.502598
C 3.721711 -1.508784 -0.503354
C -3.678305 -2.908239 0.545861
C 3.678576 -2.908427 -0.546491
C -3.675074 1.523069 0.145800
C 3.675327 1.523271 -0.146099
C -4.843371 1.222708 -0.605210
C 4.842808 1.223975 0.606634
C -3.566782 2.788705 0.784171
C 3.567416 2.788336 -0.785658
C -5.907787 2.151186 -0.704652
C 5.906842 2.152847 0.706487
C -4.620742 3.718059 0.681885
C 4.621010 3.718068 -0.683017
C -5.790938 3.401997 -0.045420
C 5.790447 3.402995 0.045925
C -7.132654 1.826506 -1.543878
C 7.130758 1.829331 1.547547
H -2.402506 -4.691697 0.371801
H 2.402696 -4.691797 -0.372217
H -4.665589 -0.988577 0.680475
H 4.665928 -0.988892 -0.681558
H -1.595265 1.054715 0.198233
H 1.595630 1.054562 -0.199891
H -4.601316 -3.467357 0.733402
H 4.601519 -3.467612 -0.734163
H -4.908131 0.276783 -1.153755
H 4.907124 0.278695 1.156323
H -2.668091 3.023477 1.365319
H 2.669328 3.022348 -1.368041
H -4.534976 4.688740 1.182878
H 4.535556 4.688272 -1.184989
H -6.609844 4.127873 -0.109727
H 6.609067 4.129167 0.110543
H -8.016587 2.392869 -1.202383
H -6.964892 2.087583 -2.606832
H -7.379770 0.750765 -1.506616
H 8.014900 2.395782 1.206742
H 6.961524 2.091173 2.610079
H 7.378356 0.753660 1.511452


