%chk=000072476.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072476

0 1
 O   -1.740300      -1.663300       1.029000    
 O  -0.3452000      -3.605800     -0.7794000    
 O   -2.342100      -2.642500      -2.367800    
 O    1.122200      0.8762000       2.442900    
 O   -1.101900      0.4829000       2.557300    
 O    1.101800       2.129300     -0.8685000    
 O   -5.316400      -2.784000      0.3747000    
 O    3.856700       2.924200      0.2557000    
 O    6.491200       2.185700      0.5530000    
 O   -6.881100       1.540900      0.2133000    
 O    6.096500     -0.5978000      0.4569000    
 O   -4.830500       3.122700      -1.303100    
 O   -3.425600       3.220600      0.4988000    
 O    7.036900      -2.417300     -0.5941000    
 N   -3.767500      -1.070600      2.7100001E-02
 N    1.381600     -8.0000004E-03 -1.3700000E-02
 N   -6.086100     -0.6247000      0.2918000    
 N    3.321700       1.831500      -2.367200    
 N    6.336600      -2.530100       1.593100    
 C  -0.3952000      -1.596000      0.5064000    
 C  -0.4615000      -2.187800     -0.8949000    
 C   -1.860500      -1.809700      -1.333100    
 C   -2.647700      -1.965500     -4.3400001E-02
 C   4.8400000E-02 -0.1393000      0.5244000    
 C  -4.8599999E-02  0.4258000       1.931700    
 C   -3.570200      0.2997000     -0.1146000    
 C    1.801900       1.136900     -0.6766000    
 C   -5.067600      -1.584000      0.2404000    
 C    3.258900       1.047900      -1.134600    
 C    4.228600       1.575100     -5.4000001E-02
 C   -4.553200       1.204800     -6.3000001E-02
 C    5.709900       1.579700     -0.4785000    
 C   -5.945300      0.7485000      0.1573000    
 C    6.248800      0.1719000     -0.7316000    
 C   -4.190300       2.614000     -0.2295000    
 C    6.534800      -1.891800      0.3938000    
 H   0.2382000      -2.195200       1.172100    
 H   0.3117000      -1.850900      -1.590600    
 H   -1.840200     -0.7868000      -1.720500    
 H   -2.975300      -3.003000      8.7399997E-02
 H  -0.5952000      0.4931000     -8.7099999E-02
 H    2.053300     -0.7464000      0.1764000    
 H   0.5550000      -3.798900     -0.4661000    
 H   -3.270000      -2.399700      -2.527900    
 H   -2.557900      0.6319000     -0.2725000    
 H    3.487900      3.3000000E-03  -1.372200    
 H    4.095700       1.014600      0.8784000    
 H    5.861100       2.202200      -1.365900    
 H   -7.028500     -0.9730000      0.4444000    
 H    1.012500       1.236700       3.348600    
 H    2.687900       1.432300      -3.059300    
 H    4.252500       1.761400      -2.775200    
 H    5.728400     -0.3100000      -1.565600    
 H    7.318300      0.2335000     -0.9668000    
 H    3.940900       3.447500     -0.5598000    
 H    6.395900       1.641700       1.353600    
 H   -5.405200       2.507300      -1.807400    
 H    6.604100      -3.499600       1.726300    
 H    5.916100      -2.052000       2.382800    


%chk=000072476-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000072476

0 1
O -0.419928 -1.739921 -0.392881
O -0.393683 -3.104574 -3.270445
O -2.909849 -3.068685 -2.648633
O 0.106032 1.550747 0.244396
O -1.617472 1.015555 -1.207446
O 2.603174 1.015112 -3.462155
O -4.451885 -2.911347 -0.311091
O 5.441355 2.770303 -0.878993
O 5.780042 1.749733 1.645267
O -5.315941 0.386126 2.891964
O 3.240963 -0.005720 1.377584
O -3.442446 2.149081 3.416710
O -1.496991 2.058814 2.215878
O 3.415818 -0.400258 3.705771
N -2.665887 -1.574232 0.428530
N 2.007902 0.322352 -1.319322
N -4.832904 -1.301098 1.345760
N 5.234842 1.281816 -2.918598
N 1.575607 0.715792 2.750866
C 0.173863 -1.343553 -1.722474
C -0.844468 -1.803321 -2.790774
C -2.196096 -1.962542 -2.040637
C -1.753314 -2.263117 -0.570585
C 0.608010 0.164232 -1.711605
C -0.398404 0.977140 -0.892823
C -2.232766 -0.504136 1.163559
C 2.930103 0.716132 -2.268322
C -4.019527 -1.991809 0.439253
C 4.408498 0.730687 -1.822018
C 4.652033 1.603764 -0.513757
C -3.085253 0.252336 1.950595
C 5.433563 0.823618 0.572015
C -4.467118 -0.176999 2.117920
C 4.671123 -0.354099 1.190723
C -2.606651 1.533204 2.537401
C 2.786940 0.075827 2.737097
H 1.085781 -1.950313 -1.848258
H -0.934659 -1.086152 -3.627436
H -2.768607 -1.018092 -2.075767
H -1.786480 -3.347884 -0.358278
H 0.554772 0.527900 -2.757846
H 2.296745 0.170523 -0.336426
H -1.216717 -3.637746 -3.459593
H -3.692933 -3.288100 -2.071085
H -1.162800 -0.304958 1.107018
H 4.691759 -0.318653 -1.603926
H 3.699876 1.960242 -0.083728
H 6.361800 0.415468 0.102286
H -5.808443 -1.614900 1.405880
H -0.621209 1.904667 0.901347
H 4.634005 1.543679 -3.717738
H 6.006595 0.675149 -3.210600
H 4.692103 -1.242358 0.534844
H 5.101824 -0.612081 2.173692
H 5.683744 2.562930 -1.861577
H 6.038620 2.600650 1.194882
H -4.327456 1.628826 3.494536
H 1.126108 0.890975 3.645728
H 1.213183 1.143368 1.896416


