%chk=000102347.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102347

0 1
 O    5.151300     -0.9289000     -0.4155000    
 O   -5.752900      7.7200003E-02  0.7470000    
 C   0.5650000      0.9356000     -0.2230000    
 C  -0.2621000     -0.3624000      5.6000002E-02
 C    1.984800      0.7434000      0.3302000    
 C    2.725600     -0.4535000     -0.3050000    
 C   -1.761800     -0.2391000     -0.4230000    
 C   -2.372300       1.040500      0.2455000    
 C    4.129300     -0.3081000      0.3606000    
 C   0.4685000      -1.628700     -0.4654000    
 C    1.927000      -1.727200      2.0099999E-02
 C  -0.1134000       2.164700      0.3960000    
 C    2.981000       1.890500      0.1966000    
 C   -2.635900      -1.487300     -4.8000002E-03
 C   -1.563500       2.310000     -5.3300001E-02
 C    4.360400       1.227400      0.3672000    
 C    2.874700     -0.3398000      -1.851100    
 C   -1.806100     -0.1302000      -1.975600    
 C   -3.849600       1.258000     -9.8200001E-02
 C   -4.123700      -1.291700     -0.3503000    
 C    4.252500     -0.8736000       1.781100    
 C   -4.657800      1.5100000E-02  0.1886000    
 C   -2.520900      -1.891800       1.476300    
 H   0.6289000       1.112200      -1.301000    
 H  -0.2858000     -0.4588000       1.151300    
 H    1.870600      0.5589000       1.409300    
 H   -2.323700      0.8990000       1.334700    
 H   0.4509000      -1.660100      -1.558600    
 H  -5.3599998E-02  -2.530800     -0.1293000    
 H    1.901800      -1.902900       1.102000    
 H    2.406100      -2.606100     -0.4273000    
 H   0.4328000       3.074900      0.1221000    
 H  -8.1600003E-02   2.096100       1.491000    
 H    2.817600       2.663500      0.9545000    
 H    2.909200       2.371800     -0.7852000    
 H   -2.295200      -2.355800     -0.5845000    
 H   -2.008400       3.164200      0.4720000    
 H   -1.600800       2.552400      -1.121600    
 H    5.029300       1.540500     -0.4432000    
 H    4.826200       1.560400       1.302000    
 H    3.362600      -1.233700      -2.257000    
 H    1.917300     -0.2441000      -2.368900    
 H    3.480600      0.5214000      -2.150500    
 H   -1.490800      -1.066900      -2.447300    
 H   -2.809400      8.2300000E-02  -2.354200    
 H   -1.160900      0.6612000      -2.363700    
 H   -3.995400       1.533500      -1.147400    
 H   -4.252700       2.074900      0.5124000    
 H   -4.723500      -2.112300      6.0600001E-02
 H   -4.284300      -1.299200      -1.433300    
 H    3.528000     -0.4413000       2.476400    
 H    4.133400      -1.962700       1.782600    
 H    5.256200     -0.6841000       2.180300    
 H   -3.156400      -2.760400       1.684000    
 H   -1.501900      -2.185900       1.740800    
 H   -2.833000      -1.091400       2.152800    
 H    4.950600      -1.879400     -0.4624000    


%chk=000102347-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102347

0 1
O 5.249088 -0.912413 -0.428817
O -5.778699 -0.015162 0.906142
C 0.555138 0.955712 -0.250129
C -0.279847 -0.340445 0.035265
C 1.981840 0.758376 0.303420
C 2.727488 -0.471426 -0.306056
C -1.780917 -0.221478 -0.442455
C -2.393345 1.049702 0.250973
C 4.149086 -0.323048 0.377298
C 0.443696 -1.614927 -0.489220
C 1.904439 -1.740071 0.026565
C -0.125412 2.199010 0.371494
C 3.005277 1.915283 0.170803
C -2.622220 -1.487504 -0.006026
C -1.598088 2.336933 -0.067158
C 4.393335 1.223788 0.373838
C 2.912947 -0.348665 -1.844591
C -1.839603 -0.108288 -1.994529
C -3.907641 1.238908 -0.045431
C -4.133713 -1.305816 -0.363592
C 4.239547 -0.916516 1.800406
C -4.715080 -0.025942 0.228343
C -2.496930 -1.882315 1.487502
H 0.623524 1.120569 -1.345461
H -0.308846 -0.420471 1.146195
H 1.860102 0.550132 1.391748
H -2.296910 0.887830 1.346737
H 0.441238 -1.621252 -1.595651
H -0.114565 -2.517429 -0.174020
H 1.874639 -1.890338 1.124668
H 2.370970 -2.646747 -0.412628
H 0.439649 3.111588 0.099935
H -0.082146 2.115877 1.479149
H 2.830914 2.717397 0.909498
H 2.935312 2.378599 -0.831889
H -2.260432 -2.346459 -0.607177
H -2.068669 3.195452 0.452795
H -1.654332 2.559137 -1.152155
H 5.099609 1.460841 -0.440131
H 4.870046 1.539477 1.318996
H 3.418244 -1.247090 -2.240434
H 1.948598 -0.243543 -2.369166
H 3.545700 0.513065 -2.115237
H -1.591974 -1.076956 -2.466386
H -2.840832 0.182381 -2.358193
H -1.128397 0.639244 -2.384021
H -4.042446 1.514478 -1.112637
H -4.323281 2.064832 0.559497
H -4.726340 -2.165665 -0.004005
H -4.249551 -1.258210 -1.465036
H 3.485092 -0.484174 2.482047
H 4.102765 -2.015235 1.798845
H 5.239700 -0.699279 2.215446
H -3.126580 -2.767691 1.692674
H -1.460545 -2.142749 1.764506
H -2.840211 -1.079145 2.164960
H 5.184368 -1.900756 -0.374115


