%chk=000164512.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164512

0 1
 P   6.3900001E-02  0.3272000      0.1793000    
 O   0.2063000     -0.3572000       1.514100    
 O  -0.9961000     -0.4367000      -2.036700    
 O    1.491000      0.6028000      -1.951300    
 C   -1.256700     -0.3977000     -0.8285000    
 C    1.569200      0.1841000     -0.8017000    
 C   -2.532600     -0.9003000     -0.3300000    
 C    2.856300     -0.3689000     -0.3161000    
 C  -0.3206000       2.051000      0.2062000    
 C   -2.656400      -2.237000      4.8799999E-02
 C    3.771300      0.4784000      0.2825000    
 C   -3.628900     -4.3299999E-02 -0.2319000    
 C    3.111200      -1.719300     -0.4732000    
 C   -4.972300      -1.859800      0.6238000    
 C    5.257200      -1.401600      0.5903000    
 C   -3.876200      -2.716800      0.5256000    
 C    4.982000     -4.2300001E-02  0.7395000    
 C   -4.848700     -0.5230000      0.2451000    
 C    4.321700      -2.240100     -1.6100001E-02
 C  -0.3799000       2.770800     -0.9870000    
 C  -0.5646000       2.692000       1.420600    
 C   -1.500900      -3.179400     -4.5600001E-02
 C    3.505800       1.938300      0.4560000    
 C   -3.527100       1.393500     -0.6299000    
 C    2.129100      -2.642300      -1.118600    
 C  -0.6834000       4.132100     -0.9658000    
 C  -0.8681000       4.053300       1.441900    
 C   -6.276800      -2.373500       1.132200    
 C    6.552300      -1.957800       1.077600    
 C  -0.9277000       4.773400      0.2487000    
 H   -3.977100      -3.757500      0.8248000    
 H    5.713500      0.6067000       1.215300    
 H   -5.704000      0.1437000      0.3269000    
 H    4.538700      -3.299900     -0.1272000    
 H  -0.2239000       2.293600      -1.947500    
 H  -0.5221000       2.140700       2.355200    
 H   -1.060400      -3.157200      -1.047400    
 H  -0.7430000      -2.921600      0.6998000    
 H   -1.806100      -4.214900      0.1413000    
 H    3.236900       2.402700     -0.4984000    
 H    2.697400       2.093500       1.177200    
 H    4.387100       2.470200      0.8309000    
 H   -3.148700       1.990100      0.2020000    
 H   -4.514200       1.791900     -0.8936000    
 H   -2.908100       1.530900      -1.520100    
 H    1.716900      -2.213100      -2.037100    
 H    1.318600      -2.861700     -0.4209000    
 H    2.595300      -3.593100      -1.399900    
 H  -0.7368000       4.691200      -1.895300    
 H   -1.059100       4.552400       2.387300    
 H   -6.322700      -2.269500       2.220800    
 H   -7.116800      -1.825600      0.6918000    
 H   -6.413300      -3.429100      0.8740000    
 H    6.865400      -2.817400      0.4753000    
 H    7.352300      -1.212700       1.011300    
 H    6.455300      -2.276900       2.120000    
 H   -1.165900       5.832800      0.2650000    


%chk=000164512-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000164512

0 1
P 0.161247 1.223440 0.383543
O 0.093740 1.028036 1.998374
O -0.836809 0.175714 -1.977917
O 2.020219 1.683123 -1.640687
C -0.989978 0.026844 -0.739678
C 1.883984 0.978603 -0.616976
C -2.045594 -0.796558 -0.099066
C 2.748697 -0.173868 -0.238991
C -0.487892 2.910283 -0.103899
C -1.739629 -1.741498 0.933231
C 3.333757 -0.267765 1.064306
C -3.396369 -0.624595 -0.559928
C 2.988019 -1.185409 -1.229784
C -4.146550 -2.296576 1.103696
C 4.313233 -2.452979 0.435185
C -2.800655 -2.480884 1.501841
C 4.112354 -1.407163 1.368677
C -4.418822 -1.368802 0.068648
C 3.749693 -2.316864 -0.857025
C -0.579539 3.355397 -1.444710
C -0.897917 3.739874 0.968410
C -0.317790 -2.018519 1.385838
C 3.211167 0.852149 2.081235
C -3.762887 0.341167 -1.674994
C 2.452216 -1.084412 -2.648612
C -1.084367 4.649943 -1.705660
C -1.402520 5.030190 0.694789
C -5.269385 -3.062612 1.776899
C 5.108479 -3.689362 0.810672
C -1.494319 5.486534 -0.641306
H -2.567195 -3.221403 2.276584
H 4.580515 -1.473351 2.358414
H -5.454798 -1.223028 -0.261189
H 3.915664 -3.106560 -1.600219
H -0.260309 2.709828 -2.266877
H -0.817659 3.359913 1.993543
H 0.370341 -2.175734 0.534582
H 0.067100 -1.164980 1.976873
H -0.279501 -2.923459 2.015521
H 3.561228 1.814345 1.662367
H 2.159415 0.991138 2.403399
H 3.821140 0.634973 2.974358
H -3.328646 1.345433 -1.518076
H -4.858153 0.450944 -1.742951
H -3.387702 -0.014522 -2.650603
H 3.009002 -0.322831 -3.223637
H 1.389830 -0.784845 -2.683582
H 2.555166 -2.051751 -3.168717
H -1.152787 5.004093 -2.740083
H -1.722063 5.675926 1.520138
H -5.644610 -2.510167 2.660548
H -6.125430 -3.212175 1.096008
H -4.930696 -4.052181 2.130233
H 5.603502 -4.136740 -0.068901
H 5.882688 -3.460298 1.563619
H 4.447972 -4.464867 1.245667
H -1.884300 6.488969 -0.851833


