%chk=000150891.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150891

0 1
 O    5.334400      0.1747000       1.663900    
 O   -5.473200     -0.4483000     -0.4178000    
 O   -6.001400       2.108700      0.4675000    
 C   -2.033300      8.2999999E-03 -7.7799998E-02
 C   -1.093500      -1.138100      0.3453000    
 C   0.3162000      -1.013900     -0.2413000    
 C   0.9418000      0.3441000      0.1906000    
 C    2.386500      0.5374000     -0.4237000    
 C   -3.329900     -0.4604000      0.6189000    
 C   -1.444200       1.314300      0.4721000    
 C  -1.3600000E-02   1.546900     -4.3299999E-02
 C   -1.905600      -2.393600      4.6999998E-02
 C   -3.347300      -1.988500      0.4034000    
 C    1.204100      -2.176400      0.2268000    
 C    3.211500     -0.7503000     -0.2964000    
 C   -2.233200      0.1205000      -1.611400    
 C    3.099500       1.677700      0.3610000    
 C    2.663900      -1.940300      7.7000000E-03
 C    2.313800      0.9130000      -1.923300    
 C    4.706200     -0.6450000     -0.5236000    
 C   -4.575300      0.2014000      0.1159000    
 C    4.595600       1.811100      6.2199999E-02
 C    5.336700      0.4951000      0.2739000    
 C   -4.659700       1.701400      0.3025000    
 H  -0.9810000      -1.101400       1.442300    
 H   0.2602000      -1.060700      -1.334700    
 H    1.065800      0.2816000       1.284200    
 H   -3.276800     -0.2721000       1.700200    
 H   -1.424900       1.291600       1.569200    
 H   -2.047100       2.181000      0.1869000    
 H  -6.8999998E-02   1.791900      -1.107900    
 H   0.3848000       2.437500      0.4557000    
 H   -1.574300      -3.250900      0.6416000    
 H   -1.834900      -2.675100      -1.009600    
 H   -4.022100      -2.324700     -0.3906000    
 H   -3.667000      -2.489100       1.324900    
 H   0.9112000      -3.087900     -0.3081000    
 H    1.051900      -2.373800       1.295200    
 H   -2.832100      0.9982000      -1.873400    
 H   -1.288900      0.2210000      -2.153200    
 H   -2.744000     -0.7533000      -2.029100    
 H    2.980600       1.511900       1.440400    
 H    2.623900       2.642400      0.1465000    
 H    3.302100      -2.815300      0.1047000    
 H    3.302800      0.9517000      -2.391900    
 H    1.722600      0.1904000      -2.495100    
 H    1.870000       1.902800      -2.071300    
 H    5.202000      -1.586600     -0.2556000    
 H    4.890300     -0.4875000      -1.592900    
 H    4.740700       2.158600     -0.9670000    
 H    5.012300       2.580000      0.7240000    
 H    6.383700      0.6193000     -2.5200000E-02
 H   -4.250700       2.208100     -0.5732000    
 H   -4.113500       2.005300       1.199100    
 H    5.829100     -0.6550000       1.774600    
 H   -6.326100       1.719800       1.297600    


%chk=000150891-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150891

0 1
O 5.370339 0.288937 1.694327
O -5.303382 -0.049135 -0.763306
O -6.148227 2.220604 0.372394
C -2.012766 0.055385 -0.091513
C -1.072859 -1.117984 0.334003
C 0.349122 -1.026856 -0.255132
C 0.995774 0.339973 0.138993
C 2.434003 0.526332 -0.478312
C -3.334963 -0.406612 0.660459
C -1.379869 1.371518 0.419226
C 0.054285 1.545258 -0.148549
C -1.915311 -2.390505 0.080670
C -3.378615 -1.955981 0.432568
C 1.225635 -2.192326 0.262501
C 3.258237 -0.765350 -0.303269
C -2.259662 0.112742 -1.621987
C 3.161198 1.680072 0.299279
C 2.703242 -1.958592 0.040890
C 2.366896 0.875609 -1.998386
C 4.758317 -0.657095 -0.544759
C -4.586941 0.317170 0.215418
C 4.664131 1.821411 -0.023907
C 5.417117 0.507114 0.232911
C -5.009232 1.573659 0.983160
H -0.953272 -1.021781 1.439508
H 0.295929 -1.102662 -1.361010
H 1.141216 0.295872 1.243280
H -3.172543 -0.183180 1.735642
H -1.338167 1.349545 1.529063
H -1.988786 2.252262 0.131727
H -0.018640 1.714705 -1.238590
H 0.491927 2.466251 0.280073
H -1.579077 -3.244241 0.694927
H -1.839919 -2.702305 -0.978315
H -4.081495 -2.189026 -0.385684
H -3.750111 -2.465818 1.339189
H 0.920433 -3.140401 -0.224592
H 1.034168 -2.341144 1.349358
H -2.859977 1.001957 -1.887913
H -1.312264 0.172992 -2.183043
H -2.812893 -0.769659 -1.985050
H 3.066326 1.483248 1.384123
H 2.655005 2.641482 0.088518
H 3.363051 -2.830649 0.169038
H 3.366560 0.842481 -2.466366
H 1.728093 0.158410 -2.544589
H 1.965832 1.892469 -2.160928
H 5.250833 -1.616636 -0.287191
H 4.966074 -0.484985 -1.622042
H 4.819586 2.117591 -1.079565
H 5.108729 2.614745 0.605115
H 6.477928 0.605126 -0.086451
H -4.155451 2.280332 1.032778
H -5.248147 1.271900 2.027144
H 5.625396 -0.648202 1.888159
H -6.441213 1.623474 -0.375590


