%chk=000087524.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087524

0 1
 O   0.5967000       2.236600     -0.6938000    
 O   -1.097100       3.625200      -1.402300    
 O   -1.464100     -0.3615000       2.973500    
 O   -5.045000      0.5698000     -6.7199998E-02
 O   -4.092700     -0.7326000       2.183900    
 C    4.303800      -2.080100      0.2051000    
 C    3.488100      -3.139100      0.9547000    
 C    4.100600     -0.6611000      0.7422000    
 C    1.968700      -2.935400      0.9508000    
 C    4.955100      0.3507000     -2.5000000E-02
 C    1.352900      -2.985800     -0.4493000    
 C    4.779400       1.792100      0.4651000    
 C  -0.1745000      -2.860000     -0.4446000    
 C    3.357500       2.329100      0.2748000    
 C  -0.8567000      -2.995900      -1.810100    
 C    2.931600       2.405200      -1.192500    
 C   -2.373800      -2.810000      -1.755700    
 C    1.552600       3.016300      -1.401300    
 C   -3.001700      -2.961500      -3.132600    
 C  -0.6963000       2.654100     -0.7795000    
 C   -1.590300       1.761000      9.9999997E-05
 C   -2.913800       1.577400     -0.3998000    
 C   -1.107300       1.107500       1.133900    
 C   -1.947800      0.2706000       1.867800    
 C   -3.754400      0.7403000      0.3340000    
 C   -3.271400      8.6999997E-02   1.467800    
 H    5.365400      -2.345200      0.2868000    
 H    4.061200      -2.111700     -0.8633000    
 H    3.717700      -4.123000      0.5271000    
 H    3.827800      -3.170000       1.997500    
 H    3.045300     -0.3929000      0.6427000    
 H    4.351000     -0.6266000       1.808900    
 H    1.520400      -3.730100       1.560600    
 H    1.705600      -1.992300       1.442400    
 H    6.011700      8.0200002E-02  9.7900003E-02
 H    4.751000      0.2825000      -1.099100    
 H    1.762300      -2.179000      -1.067600    
 H    1.631000      -3.930700     -0.9318000    
 H    5.041800       1.848200       1.528500    
 H    5.486500       2.438200     -6.8800002E-02
 H  -0.5900000      -3.621500      0.2276000    
 H  -0.4413000      -1.887900     -1.2200000E-02
 H    3.322000       3.340800      0.6990000    
 H    2.642400       1.737200      0.8553000    
 H  -0.6248000      -3.984100      -2.226200    
 H  -0.4269000      -2.255300      -2.495900    
 H    3.668300       2.982700      -1.762800    
 H    2.912200       1.392700      -1.611400    
 H   -2.813800      -3.546500      -1.073700    
 H   -2.610600      -1.816900      -1.358300    
 H    1.538200       4.046900      -1.028100    
 H    1.309000       3.017600      -2.469900    
 H   -2.603400      -2.217100      -3.829300    
 H   -2.808300      -3.957000      -3.544800    
 H   -4.085800      -2.823600      -3.071400    
 H   -3.291600       2.083500      -1.285100    
 H  -8.1000000E-02   1.250200       1.463700    
 H  -0.5285000     -0.1237000       3.091900    
 H   -5.200300       1.096700     -0.8698000    
 H   -3.586800      -1.098000       2.930300    


%chk=000087524-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000087524

0 1
O 0.628626 2.342127 -0.684037
O -1.030725 3.948294 -1.017631
O -1.554614 -1.299226 2.188782
O -5.015030 1.925735 1.681927
O -4.045894 -0.462376 2.666913
C 4.067257 -1.972894 0.580949
C 3.080990 -2.829025 1.416590
C 3.914920 -0.447652 0.783643
C 1.584674 -2.661968 1.045003
C 4.910281 0.372553 -0.069998
C 1.219345 -3.135474 -0.382187
C 4.897270 1.895323 0.225332
C -0.288495 -3.018310 -0.701014
C 3.521923 2.588541 0.059991
C -0.657689 -3.522415 -2.114948
C 2.947283 2.522963 -1.373235
C -2.163392 -3.383043 -2.435257
C 1.567493 3.173206 -1.494368
C -2.526198 -3.879557 -3.851400
C -0.664327 2.853630 -0.516073
C -1.513850 1.959916 0.311805
C -2.841137 2.374720 0.586444
C -1.027660 0.730628 0.827160
C -1.888696 -0.057891 1.605116
C -3.695209 1.575555 1.373913
C -3.220950 0.343103 1.893354
H 5.102709 -2.264340 0.852176
H 3.956396 -2.213727 -0.495949
H 3.348915 -3.899855 1.306151
H 3.216104 -2.581040 2.489553
H 2.880198 -0.137790 0.535747
H 4.064579 -0.204669 1.857035
H 0.976884 -3.238159 1.776915
H 1.305465 -1.590278 1.157582
H 5.936313 -0.010837 0.107702
H 4.701009 0.192164 -1.144210
H 1.791226 -2.550634 -1.129694
H 1.538282 -4.191745 -0.501345
H 5.247147 2.056842 1.265608
H 5.637843 2.394274 -0.433804
H -0.873078 -3.589512 0.051334
H -0.606252 -1.957602 -0.609900
H 3.621862 3.653876 0.353638
H 2.789256 2.144777 0.759775
H -0.357568 -4.586342 -2.217080
H -0.069686 -2.959239 -2.869679
H 3.632561 3.040218 -2.075784
H 2.872439 1.473373 -1.715855
H -2.750056 -3.947621 -1.682046
H -2.460934 -2.320330 -2.326026
H 1.550502 4.206684 -1.101512
H 1.198499 3.191603 -2.536460
H -1.976109 -3.309822 -4.624155
H -2.268102 -4.948327 -3.976120
H -3.606896 -3.767262 -4.054916
H -3.181631 3.331355 0.171700
H 0.000552 0.425229 0.614092
H -0.673955 -1.634758 1.887685
H -5.243662 2.795221 1.268190
H -3.529206 -1.273993 2.923578


