%chk=000171009.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171009

0 1
 O   -3.158700     -0.6853000      -1.171000    
 O    4.204400     -0.6512000      -1.379800    
 O   -6.061100      0.9050000     -0.3472000    
 C   -2.881300     -0.8931000      0.2310000    
 C  -0.6889000      0.2781000      0.2620000    
 C   9.8999999E-03  -1.108800      0.3508000    
 C   -2.100200      0.2140000      0.9036000    
 C    1.364200      -1.099600     -0.4099000    
 C    2.191100      0.2249000     -0.2751000    
 C   -4.282000     -0.6382000     -0.2893000    
 C   -2.292700      -2.255900      0.4369000    
 C  -0.8798000      -2.273300     -0.1586000    
 C   0.1938000       1.360400      0.9117000    
 C    1.687900       1.025100      0.9511000    
 C    3.660000     -0.2855000     -0.1075000    
 C    2.286900      -2.237200      8.4799998E-02
 C   -2.880000       1.541200       1.019800    
 C    3.498200      -1.560900      0.7149000    
 C    2.056300       1.098400      -1.542900    
 C   -4.855600      0.7228000     -0.2368000    
 C   -3.844400       1.839300     -0.1194000    
 C    2.899700       2.345200      -1.425400    
 C    4.565800      0.6749000      0.5353000    
 C    5.306600       1.459700       1.061100    
 H  -0.8146000      0.5264000     -0.8001000    
 H   0.2041000      -1.306000       1.415700    
 H   -1.941500     -0.1026000       1.946300    
 H    1.159800      -1.281200      -1.474200    
 H   -4.977400      -1.468200     -0.3090000    
 H   -2.904500      -3.031200     -3.8500000E-02
 H   -2.254000      -2.487100       1.507600    
 H  -0.4115000      -3.237600      6.8800002E-02
 H  -0.9569000      -2.213700      -1.252100    
 H  -0.1264000       1.552000       1.943700    
 H   4.9100000E-02   2.304000      0.3707000    
 H    2.251300       1.942400       1.142600    
 H    1.852100      0.4220000       1.854900    
 H    2.606100      -2.840500     -0.7744000    
 H    1.810400      -2.920000      0.7948000    
 H   -2.206200       2.392100       1.157000    
 H   -3.476300       1.487000       1.942300    
 H    3.302400      -1.346400       1.772200    
 H    4.374500      -2.217000      0.6637000    
 H    1.016100       1.394100      -1.710700    
 H    2.347300      0.5443000      -2.443200    
 H   -3.318800       1.957300      -1.072500    
 H   -4.381100       2.771600      8.7499999E-02
 H    2.682200       2.965400     -0.5549000    
 H    3.970800       2.141600      -1.479600    
 H    2.689300       2.981500      -2.294700    
 H    5.068700      -1.071800      -1.230600    
 H    5.962800       2.156900       1.527200    


%chk=000171009-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000171009

0 1
O -3.356521 -0.667039 -1.243619
O 4.311010 -0.607823 -1.298959
O -6.213649 0.657455 0.613718
C -2.902422 -0.872816 0.189018
C -0.678772 0.304591 0.156675
C 0.018087 -1.083348 0.278374
C -2.103424 0.282538 0.804065
C 1.389614 -1.095893 -0.466364
C 2.239376 0.231640 -0.272405
C -4.375649 -0.731390 -0.115658
C -2.280524 -2.242511 0.403748
C -0.877049 -2.234507 -0.248401
C 0.216900 1.416895 0.793687
C 1.698355 0.999174 0.963951
C 3.700685 -0.302699 0.026865
C 2.302140 -2.284027 -0.015322
C -2.835864 1.668826 0.804813
C 3.458261 -1.640529 0.779864
C 2.184462 1.108999 -1.559119
C -5.033409 0.589215 0.174379
C -4.123793 1.779532 -0.071486
C 2.956706 2.444905 -1.513581
C 4.594319 0.602112 0.774289
C 5.401315 1.292166 1.401167
H -0.814573 0.514866 -0.925630
H 0.201145 -1.268913 1.362190
H -1.949607 -0.005752 1.867773
H 1.164820 -1.196397 -1.547171
H -5.020340 -1.619020 -0.117568
H -2.912070 -3.024267 -0.055990
H -2.206564 -2.458002 1.488231
H -0.379788 -3.208256 -0.079087
H -1.005794 -2.122297 -1.343483
H -0.181688 1.688920 1.791560
H 0.164216 2.335609 0.179770
H 2.312698 1.895890 1.161291
H 1.795685 0.360658 1.863387
H 2.709968 -2.805779 -0.898529
H 1.753332 -3.027504 0.590783
H -2.138011 2.460225 0.480509
H -3.122525 1.916667 1.843983
H 3.166011 -1.432210 1.825505
H 4.375075 -2.257273 0.809007
H 1.119596 1.311753 -1.788047
H 2.576194 0.501731 -2.394468
H -3.842304 1.781575 -1.140694
H -4.666535 2.710231 0.164405
H 2.585176 3.120211 -0.720584
H 4.032954 2.275945 -1.339371
H 2.850302 2.975916 -2.477727
H 5.231203 -0.941743 -1.139391
H 6.089171 1.917047 1.940247


