%chk=000103209.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103209

0 1
 O   -2.881400     -0.5645000      0.1339000    
 O    3.186300      -1.224200     -0.1646000    
 O   -4.184300      -2.437200      0.2940000    
 O    4.492800      0.6506000     -0.2550000    
 O   -11.56210       3.711800     -0.9930000    
 O    10.15690       4.450100      0.8772000    
 N   -5.106400     -0.2858000      0.2519000    
 N    5.412900      -1.502000     -0.2518000    
 N   -10.14610       1.840100     -0.9089000    
 N    9.438200       2.214300      0.8671000    
 C  -0.4923000     -0.4875000     -8.7000001E-03
 C   0.7952000      -1.302400     -6.2899999E-02
 C   -1.719100      -1.381300      0.1030000    
 C    2.024200     -0.4074000     -0.1314000    
 C   -6.497400     -0.5195000      0.3437000    
 C    6.805400      -1.267400     -0.3144000    
 C   -8.759700      0.3229000      0.4390000    
 C    8.666500      0.2693000     -0.4221000    
 C   -7.387300      0.5546000      0.3482000    
 C    7.292200      3.9000001E-02 -0.3602000    
 C   -4.086800      -1.217500      0.2335000    
 C    4.393600     -0.5700000     -0.2277000    
 C   -6.980200      -1.825300      0.4300000    
 C    7.693100      -2.343400     -0.3302000    
 C   -9.242400     -0.9828000      0.5252000    
 C    9.554000     -0.8065000     -0.4379000    
 C   -9.711100       1.471200      0.4441000    
 C    9.186900       1.665800     -0.4716000    
 C   -8.352600      -2.057100      0.5207000    
 C    9.067300      -2.112900     -0.3920000    
 C   -10.85260       2.774700     -0.9471000    
 C    9.796500       3.330300      0.8683000    
 H  -0.4702000      0.2031000      0.8437000    
 H  -0.5804000      0.1427000     -0.9025000    
 H   0.7842000      -1.973800     -0.9307000    
 H   0.8703000      -1.952400      0.8179000    
 H   -1.770900      -2.055900     -0.7597000    
 H   -1.666900      -1.976800       1.022000    
 H    1.986800      0.2117000      -1.035500    
 H    2.062800      0.2448000      0.7490000    
 H   -7.011400       1.573000      0.2788000    
 H    6.654200      0.9119000     -0.3476000    
 H   -4.825200      0.6899000      0.1920000    
 H    5.130200      -2.478500     -0.2210000    
 H   -6.353000      -2.705900      0.4321000    
 H    7.327000      -3.366300     -0.2947000    
 H   -10.30950      -1.176900      0.5944000    
 H    10.62710     -0.6406000     -0.4839000    
 H   -10.58180       1.213300       1.064800    
 H   -9.234100       2.328600      0.9420000    
 H    10.11190       1.682600      -1.066700    
 H    8.470900       2.297300      -1.018400    
 H   -8.729800      -3.073500      0.5874000    
 H    9.758500      -2.950700     -0.4038000    


%chk=000103209-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000103209

0 1
O -3.099141 -0.699520 0.128728
O 3.084997 -1.089777 0.120837
O -4.338546 -2.688081 0.381688
O 4.340139 0.877926 -0.209863
O -9.399370 4.904841 -0.433505
O 12.658130 3.257831 -0.904501
N -5.351532 -0.550554 0.157496
N 5.335047 -1.260581 0.068902
N -9.354235 2.489828 -0.127468
N 10.577794 2.020510 -0.642840
C -0.685693 -0.519793 0.091233
C 0.672182 -1.259798 0.144596
C -1.851394 -1.504603 0.191216
C 1.841086 -0.278191 0.052221
C -6.741080 -0.841788 0.224370
C 6.727257 -0.986746 -0.026073
C -9.027258 0.052645 0.171818
C 8.637609 0.513962 -0.329769
C -7.636432 0.255306 0.112857
C 7.239485 0.315524 -0.244068
C -4.293758 -1.441337 0.237812
C 4.284213 -0.363970 -0.026223
C -7.246412 -2.155815 0.395727
C 7.618623 -2.085860 0.106080
C -9.537190 -1.258544 0.343669
C 9.524915 -0.576136 -0.199269
C -10.012079 1.215173 0.057540
C 9.136961 1.939373 -0.565203
C -8.644020 -2.344790 0.453126
C 9.006761 -1.873663 0.018770
C -9.449444 3.695050 -0.277397
C 11.579434 2.698543 -0.780016
H -0.756882 0.210491 0.919967
H -0.773879 0.050823 -0.853115
H 0.744404 -1.986578 -0.687130
H 0.756961 -1.834995 1.086604
H -1.854041 -2.231398 -0.642377
H -1.838589 -2.069642 1.141788
H 1.836478 0.289218 -0.896805
H 1.842328 0.445920 0.888220
H -7.256507 1.275121 -0.021193
H 6.541999 1.152398 -0.343451
H -5.081451 0.428308 0.037993
H 5.058606 -2.232595 0.223306
H -6.555893 -2.996968 0.479947
H 7.224784 -3.095876 0.275044
H -10.619587 -1.429595 0.390706
H 10.602831 -0.404396 -0.268475
H -10.699095 1.028137 -0.792928
H -10.637726 1.253072 0.972772
H 8.693795 2.329344 -1.504186
H 8.773256 2.592382 0.254228
H -9.037474 -3.358592 0.585360
H 9.689532 -2.723944 0.121135


