%chk=000146672.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146672

0 1
 O    1.902100      -1.482200      -1.169500    
 O    1.973900      -2.783300      0.8136000    
 O    1.860700       3.556100      0.9503000    
 O    3.540500       2.982000     -0.6784000    
 O   -4.064500       1.019300      -1.766300    
 C  -0.1926000      -2.223900     -0.1559000    
 C  -0.2963000     -0.9275000      0.7047000    
 C    1.295800      -2.555200     -0.4262000    
 C   0.7651000      9.1300003E-02  0.3170000    
 C  -0.9431000      -3.378500      0.5269000    
 C    1.784000     -0.2424000     -0.6001000    
 C   -1.710700     -0.3543000      0.6629000    
 C    1.459600      -3.802500      -1.301900    
 C   0.7654000       1.374800      0.8967000    
 C    2.742400      0.6984000     -0.9975000    
 C    1.731300       2.278000      0.5009000    
 C   -2.242800      7.4500002E-02 -0.5472000    
 C   -2.451800     -0.2674000       1.835300    
 C    2.689200       1.950900     -0.4266000    
 C    3.341200      -3.089700      0.6000000    
 C   -3.535400      0.5977000     -0.5855000    
 C   -3.744200      0.2556000       1.797200    
 C    3.008000       3.997500      0.1962000    
 C   -4.286100      0.6882000      0.5868000    
 C   -5.391600       1.542700      -1.733300    
 H  -0.6643000      -2.050900      -1.132900    
 H  -6.1200000E-02  -1.202800       1.743900    
 H  -0.9301000      -4.280800     -9.1899998E-02
 H  -0.5004000      -3.626100       1.497300    
 H   -1.995500      -3.127000      0.6917000    
 H   0.7796000      -3.761600      -2.160900    
 H    2.465200      -3.874000      -1.733100    
 H    1.267600      -4.726100     -0.7463000    
 H   2.2900000E-02   1.662400       1.634000    
 H    3.513600      0.4447000      -1.717300    
 H   -1.666200      1.8300001E-02  -1.466700    
 H   -2.042500     -0.6009000       2.784700    
 H    3.470300      -4.124900      0.2708000    
 H    3.847300      -3.005600       1.567100    
 H    3.840900      -2.399400     -8.5699998E-02
 H   -4.328000      0.3256000       2.710500    
 H    2.718500       4.864800     -0.4082000    
 H    3.792700       4.303300      0.8977000    
 H   -5.295200       1.083600      0.6290000    
 H   -5.451100       2.450200      -1.122900    
 H   -6.115900      0.7832000      -1.419900    
 H   -5.651600       1.828900      -2.757600    


%chk=000146672-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000146672

0 1
O 2.125025 -1.564118 -1.076791
O 1.823711 -2.883687 0.917954
O 1.789439 3.717225 0.720911
O 3.619653 3.092579 -0.698855
O -4.024649 1.224470 -1.596554
C -0.140511 -2.217997 -0.282163
C -0.220485 -0.968892 0.655740
C 1.337012 -2.657427 -0.438875
C 0.815216 0.086165 0.248852
C -1.032482 -3.369802 0.225807
C 1.923492 -0.259135 -0.568195
C -1.645299 -0.410954 0.708856
C 1.562071 -3.849544 -1.373272
C 0.703713 1.427855 0.721095
C 2.914644 0.683028 -0.959708
C 1.675021 2.348145 0.337463
C -2.231401 0.175268 -0.434926
C -2.406865 -0.492296 1.904258
C 2.756541 1.984355 -0.492173
C 3.232509 -3.285713 1.038123
C -3.557138 0.667636 -0.393508
C -3.727873 0.001992 1.942972
C 2.878212 4.252561 -0.131418
C -4.319637 0.584614 0.799223
C -5.385633 1.763508 -1.610222
H -0.477383 -1.915883 -1.294393
H 0.046724 -1.325675 1.671240
H -1.066507 -4.205997 -0.494466
H -0.651610 -3.755164 1.188291
H -2.066608 -3.015437 0.375893
H 1.005784 -3.703159 -2.314399
H 2.631971 -3.940907 -1.624394
H 1.221437 -4.783889 -0.898127
H -0.137031 1.722304 1.354728
H 3.750063 0.375780 -1.591666
H -1.667782 0.279231 -1.368493
H -1.961224 -0.942334 2.798818
H 3.392468 -4.322632 0.683840
H 3.457743 -3.229226 2.114343
H 3.890766 -2.594942 0.480210
H -4.307419 -0.062785 2.870884
H 2.437224 4.834647 -0.964234
H 3.565555 4.844092 0.491994
H -5.344309 0.964330 0.848606
H -5.498528 2.594452 -0.886481
H -6.134683 0.977440 -1.390746
H -5.534238 2.140918 -2.632645


