%chk=000146421.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146421

0 1
 O   -3.802400       2.169600      -1.248800    
 O    3.194800      -1.816200     -0.8449000    
 O   -1.882200     -0.3171000      -1.669000    
 O   0.3831000       2.175600       1.274500    
 O   -5.057700      -3.652300     -0.6047000    
 O    5.634200      -1.575800      0.3512000    
 O   -3.039400       3.298800       2.076400    
 O   -5.061600      -2.338200       1.257800    
 O   -3.441900       4.431300      0.1510000    
 N   -1.086600       1.961900     -0.5131000    
 N   -2.916000      -1.060300      0.2735000    
 N   0.5150000       4.377600      -1.099600    
 C   -2.144400       1.233300      0.1727000    
 C   -3.101100      -2.441200     -0.1470000    
 C    1.052400       3.027900     -0.8970000    
 C    2.502700       3.122300     -0.3903000    
 C   -2.095600      -3.388300      0.5171000    
 C   -3.454700       2.003600      0.1163000    
 C   -2.277700     -0.1162000     -0.5220000    
 C   0.1035000       2.347900      9.0499997E-02
 C    3.283500       1.834700     -0.2193000    
 C  -0.6643000      -3.036900      0.1915000    
 C    2.835900      0.5844000     -0.6637000    
 C   -4.497000      -2.780100      0.2682000    
 C    4.541900       1.908800      0.4045000    
 C    3.608500     -0.5648000     -0.4398000    
 C  -0.1407000      -3.279200      -1.085500    
 C   0.1416000      -2.410100       1.151800    
 C   -3.310700       3.370500      0.7478000    
 C    1.930700      -2.207500     -0.4576000    
 C    4.861100     -0.4726000      0.1641000    
 C    1.154200      -2.870600      -1.408300    
 C    1.437600      -2.005300      0.8344000    
 C    5.325600      0.7678000      0.5894000    
 C    5.467400      -2.283400       1.578100    
 H   -1.839400       1.063700       1.212000    
 H   -3.026300      -2.483400      -1.239900    
 H    1.023900       2.498600      -1.856200    
 H    2.508400       3.643600      0.5776000    
 H    3.074300       3.746100      -1.091800    
 H   -2.287200      -4.421900      0.1997000    
 H   -2.237200      -3.387400       1.606500    
 H   -4.270500       1.463900      0.6089000    
 H   -1.213100       2.143500      -1.504900    
 H   -3.222600     -0.7958000       1.205800    
 H    1.884700      0.4881000      -1.178300    
 H   0.5060000       4.887500     -0.2171000    
 H  -0.4517000       4.324700      -1.417700    
 H    4.922800       2.867900      0.7490000    
 H  -0.7477000      -3.768400      -1.843100    
 H  -0.2420000      -2.216500       2.150400    
 H    1.540800      -3.052200      -2.407400    
 H    2.039900      -1.524700       1.600000    
 H    6.297100      0.8575000       1.068000    
 H   -4.684300       2.578400      -1.279200    
 H   -5.974500      -3.888700     -0.3484000    
 H   -2.956600       4.188500       2.481300    
 H    6.198100      -3.096500       1.605600    
 H    4.464400      -2.715100       1.640900    
 H    5.647300      -1.623800       2.433100    


%chk=000146421-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000146421

0 1
O -3.784478 2.090953 -1.229254
O 3.103014 -1.615978 -0.711574
O -1.683960 -0.597617 -1.545872
O -0.119869 3.014821 1.215457
O -5.019069 -4.073155 -0.326628
O 5.679813 -1.311031 0.786076
O -3.065920 3.280403 2.127371
O -5.294611 -2.313904 1.170574
O -2.845873 4.354529 0.064213
N -0.894387 1.748338 -0.572269
N -2.936507 -1.156021 0.336726
N 0.599075 4.617720 -1.344301
C -1.968247 1.115080 0.187594
C -3.180369 -2.537656 -0.082737
C 1.043066 3.254289 -0.954915
C 2.430469 3.366009 -0.294402
C -2.160818 -3.564171 0.562696
C -3.307322 1.949800 0.129339
C -2.187257 -0.287947 -0.424097
C -0.003709 2.637473 0.004637
C 3.201172 2.077071 -0.029481
C -0.726259 -3.149547 0.301953
C 2.768632 0.797580 -0.434400
C -4.598678 -2.916722 0.322098
C 4.458149 2.161380 0.633060
C 3.542798 -0.361524 -0.183412
C -0.059198 -3.527115 -0.891689
C -0.056944 -2.282466 1.201128
C -3.053502 3.325109 0.747919
C 1.832303 -2.105521 -0.320956
C 4.791437 -0.272790 0.485086
C 1.215180 -3.017450 -1.206115
C 1.215920 -1.753724 0.902054
C 5.233438 1.018576 0.880275
C 5.225171 -2.712854 0.799261
H -1.665867 1.040040 1.250114
H -3.070143 -2.584541 -1.179801
H 1.111907 2.648593 -1.879592
H 2.297357 3.903601 0.667046
H 3.031368 4.025737 -0.949563
H -2.386060 -4.556222 0.131699
H -2.362646 -3.613307 1.649862
H -4.092164 1.424230 0.700079
H -0.730880 1.334852 -1.499638
H -3.385210 -0.848654 1.204488
H 1.821511 0.657226 -0.965672
H 0.552505 5.245358 -0.530153
H -0.298053 4.624283 -1.846356
H 4.829518 3.140033 0.959827
H -0.554280 -4.202532 -1.599730
H -0.539480 -2.005729 2.146395
H 1.724905 -3.283162 -2.136861
H 1.710265 -1.063848 1.593025
H 6.198000 1.085273 1.392867
H -3.401431 2.932357 -1.598967
H -5.931687 -4.324620 -0.017763
H -2.703898 4.124756 2.508296
H 6.067699 -3.266951 1.241426
H 5.014818 -3.075483 -0.219462
H 4.323588 -2.835726 1.428019


