%chk=000122216.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122216

0 1
 I   -3.778500      -2.403400       1.660600    
 O    2.913800       2.207600      0.6279000    
 O   -7.982200      0.8158000      0.6658000    
 N  -0.3644000     -7.6099999E-02 -0.7302000    
 C    2.026100      0.3070000     -0.5702000    
 C    2.256200      -1.195000     -0.4086000    
 C    3.624400      -1.587300     -0.9529000    
 C   0.6435000      0.6904000     -4.7200002E-02
 C    3.116100       1.095400      0.1485000    
 C    4.720300     -0.7742000     -0.3204000    
 C    4.480900      0.5065000      0.2002000    
 C   -1.707400      0.2527000     -0.2520000    
 C    6.024700      -1.288200     -0.2858000    
 C    5.526100       1.244600      0.7702000    
 C   -2.764200     -0.5951000     -0.9611000    
 C    7.064800     -0.5505000      0.2800000    
 C    6.814600      0.7127000      0.8099000    
 C   -4.155600     -0.2502000     -0.4933000    
 C   -4.749500     -0.8955000      0.5828000    
 C   -4.828200      0.7481000      -1.186300    
 C   -6.039600     -0.5367000      0.9734000    
 C   -6.118100       1.106900     -0.7957000    
 C   -6.723900      0.4644000      0.2842000    
 H    2.097300      0.5775000      -1.633100    
 H    1.501000      -1.781800     -0.9434000    
 H    2.190900      -1.473700      0.6521000    
 H    3.656700      -1.438200      -2.039000    
 H    3.787100      -2.654000     -0.7574000    
 H   0.4779000       1.764100     -0.2027000    
 H   0.5989000      0.5122000       1.035200    
 H  -0.3106000      8.3999999E-02  -1.735700    
 H   -1.762300      9.0099998E-02  0.8306000    
 H   -1.911400       1.316800     -0.4286000    
 H    6.237600      -2.271400     -0.6985000    
 H    5.358800       2.235700       1.183000    
 H   -2.551000      -1.665000     -0.8686000    
 H   -2.702700     -0.4113000      -2.043800    
 H    8.069900     -0.9613000      0.3059000    
 H    7.624900       1.286600       1.250200    
 H   -4.368500       1.259800      -2.027400    
 H   -6.521600      -1.030600       1.814400    
 H   -6.645900       1.888300      -1.335700    
 H   -8.244900      0.2717000       1.427900    


%chk=000122216-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000122216

0 1
I -3.779537 -2.573559 1.403472
O 3.049067 2.285729 0.580517
O -8.202429 0.657760 0.634664
N -0.382322 0.131393 -0.738739
C 2.075684 0.264992 -0.415029
C 2.297455 -1.239170 -0.123591
C 3.628149 -1.720679 -0.733452
C 0.694744 0.771040 0.055394
C 3.230956 1.106721 0.150449
C 4.801520 -0.862895 -0.280672
C 4.596159 0.484510 0.145730
C -1.751634 0.386030 -0.245065
C 6.119140 -1.382198 -0.271882
C 5.700761 1.275659 0.564773
C -2.783009 -0.407398 -1.088524
C 7.212202 -0.590213 0.140484
C 7.003780 0.747293 0.561713
C -4.208237 -0.197237 -0.609251
C -4.827417 -0.950917 0.419680
C -4.995787 0.842014 -1.184328
C -6.146565 -0.700429 0.859404
C -6.309836 1.122915 -0.771237
C -6.886531 0.344987 0.257344
H 2.130455 0.395485 -1.523320
H 1.440718 -1.803228 -0.532200
H 2.307190 -1.399406 0.973482
H 3.552243 -1.677571 -1.841526
H 3.817833 -2.780156 -0.478701
H 0.679511 1.883021 0.015928
H 0.548032 0.488893 1.116352
H -0.298000 0.380446 -1.736559
H -1.805321 0.048178 0.807549
H -2.030914 1.469317 -0.250782
H 6.287306 -2.419473 -0.586485
H 5.499971 2.303461 0.885298
H -2.497407 -1.474039 -1.055206
H -2.703956 -0.081570 -2.145042
H 8.223229 -1.013426 0.140360
H 7.851356 1.361955 0.883198
H -4.550389 1.442244 -1.986560
H -6.590912 -1.309818 1.654206
H -6.897353 1.924262 -1.227440
H -8.517904 0.064474 1.360798


