%chk=000141789.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000141789

0 1
 O    2.937600       3.086100       1.098100    
 O   -2.937600       3.086300      -1.097600    
 O    2.937600       3.086600      -1.097200    
 O   -2.937500       3.086600       1.097600    
 O   -1.647500     -0.9197000       2.993600    
 O    1.647700     -0.9194000      -2.993800    
 O   -2.793000      0.9487000      -2.994100    
 O    2.792800      0.9484000       2.994100    
 O   -2.795400      0.9515000       2.992200    
 O    2.795600      0.9517000      -2.992200    
 O   -1.646500     -0.9233000      -2.993300    
 O    1.646300     -0.9236000       2.993200    
 O   -6.554800      -2.639600       1.097400    
 O    6.554800      -2.639500      -1.097500    
 O   -6.554500      -2.640400      -1.097900    
 O    6.554400      -2.640600       1.097800    
 N    2.422600       2.771300      3.9999999E-04
 N   -2.422600       2.771300     -9.9999997E-05
 N   -2.465300     -0.1341000       2.462000    
 N    2.465400     -0.1339000      -2.462100    
 N   -2.463900     -0.1367000      -2.462700    
 N    2.463800     -0.1369000       2.462600    
 N   -6.035800      -2.322700     -3.0000001E-04
 N    6.035800      -2.322700      9.9999997E-05
 C   -1.207900      0.6326000     -9.9999997E-05
 C    1.208000      0.6326000      9.9999997E-05
 C   -2.445900     -0.1244000     -3.0000001E-04
 C    2.445900     -0.1244000      3.0000001E-04
 C    0.000000     -6.4900003E-02 -9.9999997E-05
 C    1.208000       2.027500      1.9999999E-04
 C   -1.207900       2.027500       0.000000    
 C    0.000000       2.724900       0.000000    
 C   -3.041000     -0.4883000       1.207700    
 C    3.041000     -0.4882000      -1.207700    
 C   -3.040400     -0.4891000      -1.208300    
 C    3.040200     -0.4893000       1.208200    
 C   -4.230400      -1.216800       1.207800    
 C    4.230500      -1.216700      -1.207900    
 C   -4.229800      -1.217600      -1.208300    
 C    4.229800      -1.217700       1.208100    
 C   -4.824800      -1.581500     -1.9999999E-04
 C    4.824800      -1.581500      1.9999999E-04
 H    0.000000      -1.154100     -3.0000001E-04
 H    0.000000       3.813600       0.000000    
 H   -4.678600      -1.490600       2.160900    
 H    4.678700      -1.490300      -2.161100    
 H   -4.677600      -1.492100      -2.161400    
 H    4.677500      -1.492400       2.161300    


%chk=000141789-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000141789

0 1
O 3.557968 2.362559 0.008783
O -3.576279 2.333579 -0.028096
O 2.405069 4.330170 -0.013860
O -2.439022 4.310372 -0.040503
O -1.911221 1.075731 2.569339
O 1.916150 1.073799 -2.580604
O -2.799922 -0.797750 -3.563443
O 2.812588 -0.732978 3.573139
O -2.847669 -0.765551 3.535897
O 2.851604 -0.778203 -3.527728
O -1.893934 1.063171 -2.605047
O 1.880343 1.102527 2.591703
O -6.224935 -3.207793 1.118120
O 6.243873 -3.177900 -1.084956
O -6.213902 -3.213973 -1.168121
O 6.229687 -3.163722 1.201235
N 2.456926 3.048937 -0.003682
N -2.480664 3.028715 -0.030172
N -2.570204 -0.029889 2.518462
N 2.574659 -0.031522 -2.518176
N -2.543015 -0.048210 -2.550714
N 2.543417 -0.001141 2.550822
N -5.772251 -2.824504 -0.023889
N 5.788101 -2.786205 0.052984
C -1.238206 0.861645 -0.012282
C 1.232166 0.871985 0.002085
C -2.495320 0.029559 -0.015814
C 2.495904 0.050110 0.015214
C -0.000054 0.178317 -0.001795
C 1.193711 2.287021 -0.006112
C -1.211489 2.276928 -0.019763
C -0.011758 2.999145 -0.017145
C -3.064647 -0.486917 1.185005
C 3.069688 -0.473982 -1.180241
C -3.051580 -0.495040 -1.219357
C 3.054672 -0.459274 1.224122
C -4.125699 -1.407534 1.205922
C 4.135666 -1.389106 -1.191651
C -4.112490 -1.415871 -1.245374
C 4.120635 -1.373883 1.259571
C -4.641150 -1.852347 -0.021076
C 4.652280 -1.819677 0.039909
H 0.004408 -0.916826 0.004240
H -0.016416 4.092612 -0.023673
H -4.533818 -1.767038 2.154568
H 4.546456 -1.755431 -2.136539
H -4.510367 -1.782235 -2.195740
H 4.520140 -1.728182 2.213834


