%chk=000123810.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123810

0 1
 I    11.75980       1.821900     -1.0200000E-02
 O   -12.58840       1.020700     -3.4000000E-03
 O   -11.70610      -1.053600     -0.3141000    
 C   -1.442800     -0.6360000      1.9300001E-02
 C   -2.631900      0.3170000      0.1609000    
 C  -8.5199997E-02  6.6799998E-02  0.1133000    
 C   -3.960700     -0.4323000      3.7000000E-02
 C    1.103600     -0.8904000     -3.8999999E-03
 C   -5.150700      0.5251000      0.1398000    
 C    2.432100     -0.1381000      0.1090000    
 C   -6.478400     -0.2300000      4.8900001E-02
 C    3.659500      -1.051500      3.0900000E-02
 C   -7.706500      0.6826000      0.1237000    
 C    5.019400     -0.3466000      5.5700000E-02
 C   -9.032500     -6.7800000E-02 -4.2100001E-02
 C    6.204300      -1.304800     -8.5699998E-02
 C   -10.24240      0.8632000      5.0999999E-02
 C    7.518700     -0.5656000     -6.7699999E-02
 C    8.077100     -0.1070000      -1.260900    
 C    8.175900     -0.3403000       1.141800    
 C   -11.55840      0.1440000     -0.1221000    
 C    9.292600      0.5769000      -1.244500    
 C    9.391500      0.3436000       1.158200    
 C    9.949800      0.8022000     -3.5000000E-02
 H   -1.502600      -1.405100      0.7994000    
 H   -1.508000      -1.156800     -0.9441000    
 H   -2.582400      0.8246000       1.131700    
 H   -2.572000       1.091600     -0.6131000    
 H  -1.9400001E-02  0.8249000     -0.6769000    
 H  -2.6000001E-02  0.6006000       1.070000    
 H   -4.028100      -1.190800      0.8263000    
 H   -3.998200     -0.9604000     -0.9236000    
 H    1.059000      -1.417800     -0.9641000    
 H    1.043300      -1.648800      0.7858000    
 H   -5.095400       1.269100     -0.6640000    
 H   -5.106200       1.070700       1.090000    
 H    2.461700      0.4135000       1.056800    
 H    2.492100      0.6080000     -0.6930000    
 H   -6.508300     -0.7898000     -0.8943000    
 H   -6.532900     -0.9698000      0.8572000    
 H    3.593100      -1.643200     -0.8912000    
 H    3.618500      -1.768400      0.8608000    
 H   -7.631000       1.450700     -0.6559000    
 H   -7.704300       1.207300       1.087000    
 H    5.108500      0.2182000      0.9926000    
 H    5.048100      0.3938000     -0.7542000    
 H   -9.110300     -0.8463000      0.7270000    
 H   -9.041200     -0.5842000      -1.010100    
 H    6.117500      -1.876400      -1.018400    
 H    6.187500      -2.045800      0.7234000    
 H   -10.25020       1.352800       1.031400    
 H   -10.17300       1.631500     -0.7274000    
 H    7.573300     -0.2750000      -2.209100    
 H    7.749700     -0.6912000       2.077900    
 H    9.709700      0.9262000      -2.185700    
 H    9.886600      0.5090000       2.111700    
 H   -13.45850      0.5777000     -9.8300003E-02


%chk=000123810-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000123810

0 1
I 11.942095 1.878455 0.328075
O -12.753808 1.076733 0.159491
O -11.885498 -1.073427 0.062227
C -1.430738 -0.646143 -0.043736
C -2.651222 0.300304 0.006636
C -0.075348 0.095728 -0.018209
C -4.003844 -0.446856 -0.004346
C 1.141229 -0.855197 -0.077655
C -5.226890 0.496471 0.039998
C 2.499491 -0.119612 -0.030293
C -6.577143 -0.254815 0.035683
C 3.711209 -1.075950 -0.103796
C -7.801377 0.686978 0.076608
C 5.070105 -0.346277 -0.025607
C -9.145038 -0.074301 0.073886
C 6.279508 -1.319371 -0.120110
C -10.353531 0.879729 0.114658
C 7.616528 -0.602781 -0.020272
C 8.246399 -0.067734 -1.173070
C 8.250530 -0.411309 1.233848
C -11.687447 0.160111 0.107436
C 9.468292 0.638162 -1.086889
C 9.472145 0.291703 1.344434
C 10.070952 0.812736 0.177533
H -1.478147 -1.349965 0.813637
H -1.489409 -1.270151 -0.960228
H -2.588581 0.930972 0.918292
H -2.610217 0.997617 -0.856319
H -0.028803 0.804780 -0.871187
H -0.013429 0.713338 0.902334
H -4.045234 -1.140826 0.861257
H -4.063993 -1.081625 -0.913272
H 1.085422 -1.462727 -1.005316
H 1.085299 -1.573596 0.767013
H -5.188300 1.187198 -0.828393
H -5.164898 1.134194 0.946811
H 2.559927 0.478280 0.903046
H 2.553793 0.606556 -0.868037
H -6.637504 -0.894592 -0.869400
H -6.615825 -0.943705 0.905133
H 3.660562 -1.659351 -1.047258
H 3.644659 -1.815619 0.721696
H -7.761859 1.374492 -0.794465
H -7.738791 1.327445 0.981599
H 5.135570 0.221842 0.924269
H 5.141710 0.401856 -0.840856
H -9.189529 -0.761598 0.940455
H -9.212754 -0.714805 -0.826350
H 6.212773 -1.870643 -1.078772
H 6.190095 -2.071281 0.688444
H -10.322450 1.525426 1.014515
H -10.340560 1.575402 -0.747755
H 7.782696 -0.206534 -2.157437
H 7.790029 -0.820098 2.141586
H 9.939875 1.037086 -1.989783
H 9.945924 0.423295 2.321582
H -13.613752 0.574398 0.152129


