%chk=000035199.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035199

0 1
 O    4.837500       3.259200     -5.3599998E-02
 O   -4.847100       3.251200     -5.4900002E-02
 O    2.715800       3.274100     -0.6167000    
 O   -2.725000       3.271100     -0.6166000    
 N   3.1999999E-03 -0.7482000      0.1527000    
 N   -1.194100      -2.760200     -0.3730000    
 N    1.205400      -2.757200     -0.3729000    
 N    3.741500       2.671100     -0.2183000    
 N   -3.749600       2.665600     -0.2190000    
 C    2.372000     -0.7624000      0.1470000    
 C   -2.365800     -0.7679000      0.1467000    
 C    1.119700      -1.464000     -3.4699999E-02
 C   -1.118000      -1.463100     -3.3700000E-02
 C    2.451900      0.6041000     -0.1211000    
 C   -2.455000      0.6018000     -0.1208000    
 C    3.499800      -1.453200      0.5905000    
 C   -3.498100      -1.457900      0.5911000    
 C    3.659400       1.279800      5.4400001E-02
 C   -3.664200       1.274700      5.4099999E-02
 C   6.3999998E-03  -3.342100     -0.5253000    
 C    4.707300     -0.7775000      0.7659000    
 C   -4.707400     -0.7850000      0.7662000    
 C    4.787000      0.5890000      0.4979000    
 C   -4.790400      0.5813000      0.4976000    
 C   7.8999996E-03  -4.784300     -0.9037000    
 H    1.572300       1.136200     -0.4776000    
 H   -1.576800       1.136700     -0.4770000    
 H    3.467700      -2.516100      0.8174000    
 H   -3.464400      -2.520900      0.8184000    
 H    5.584800      -1.315000       1.113500    
 H   -5.583700      -1.324500       1.113700    
 H    5.744200       1.082400      0.6465000    
 H   -5.748700       1.072500      0.6458000    
 H  -1.1000000E-02  -4.880000      -1.993300    
 H   0.9032000      -5.285600     -0.5229000    
 H  -0.8679000      -5.294700     -0.4911000    


%chk=000035199-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000035199

0 1
O 4.869833 3.397405 0.210770
O -4.876612 3.387273 0.205293
O 2.589276 3.428354 0.215538
O -2.596133 3.423138 0.205121
N 0.000943 -0.767268 0.029034
N -1.206320 -2.866705 -0.061403
N 1.212800 -2.864143 -0.061594
N 3.719948 2.810553 0.185793
N -3.725525 2.802838 0.179289
C 2.452244 -0.754411 0.027374
C -2.450422 -0.759761 0.027267
C 1.163520 -1.491409 -0.003696
C -1.160160 -1.494075 -0.003843
C 2.462542 0.660467 0.090813
C -2.463666 0.655214 0.087775
C 3.680923 -1.468419 -0.006854
C -3.677615 -1.476445 -0.004158
C 3.702892 1.323040 0.118457
C -3.705396 1.315216 0.115337
C 0.004005 -3.507377 -0.089015
C 4.909921 -0.777057 0.021865
C -4.908049 -0.787652 0.024565
C 4.934575 0.632151 0.085304
C -4.935636 0.621632 0.085081
C 0.005018 -5.007523 -0.176384
H 1.526881 1.223787 0.117824
H -1.529167 1.220560 0.112557
H 3.643478 -2.560368 -0.055489
H -3.637917 -2.568406 -0.050753
H 5.851029 -1.334861 -0.004865
H -5.847998 -1.347511 0.000092
H 5.869389 1.198308 0.109340
H -5.871623 1.185851 0.109003
H -0.019073 -5.319896 -1.238082
H 0.921684 -5.418901 0.273166
H -0.889790 -5.422602 0.312676


