%chk=000156706.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156706

0 1
 O    1.997100     -0.3318000      0.1730000    
 O  -0.6707000       1.672200     -9.0499997E-02
 O   -1.735500     -0.4778000      -1.883700    
 O    1.046500     -0.8669000      -1.863300    
 O  -0.5467000      0.7882000       2.040200    
 N   -2.298100      -1.899000     -0.1178000    
 C  -0.3240000     -0.6370000      0.1066000    
 C  -0.3359000      -1.800400       1.116700    
 C   -1.791200      -2.225000       1.182900    
 C   -1.511500     -0.9689000     -0.7868000    
 C   0.9647000     -0.6325000     -0.6652000    
 C  -0.5236000      0.6703000      0.8224000    
 C    3.291900     -0.2937000     -0.4353000    
 C  -0.8702000       2.979100      0.4575000    
 C    4.322000      5.0900001E-02  0.6191000    
 C   -1.015000       3.972200     -0.6758000    
 H   6.2899999E-02  -1.562300       2.108000    
 H   0.2623000      -2.638700      0.7333000    
 H   -1.914300      -3.293700       1.375500    
 H   -2.354900      -1.648800       1.923000    
 H   -3.172100      -2.258000     -0.4889000    
 H    3.520000      -1.273300     -0.8698000    
 H    3.301700      0.4660000      -1.224900    
 H   -1.777700       2.982700       1.071400    
 H  -9.2000002E-03   3.249400       1.079000    
 H    5.326100      8.8799998E-02  0.1876000    
 H    4.096300       1.020100       1.075800    
 H    4.311000     -0.6903000       1.425100    
 H   -1.169500       4.984400     -0.2918000    
 H  -0.1217000       3.966500      -1.309300    
 H   -1.861000       3.704000      -1.317200    


%chk=000156706-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000156706

0 1
O 1.917430 -0.152472 0.074084
O -0.429582 1.584943 0.038055
O -1.824405 -0.497870 -1.912022
O 1.151379 -1.555023 -1.621344
O -0.997520 0.628061 2.083420
N -2.448705 -1.949092 -0.161871
C -0.390956 -0.818254 0.165065
C -0.493694 -2.011481 1.163424
C -1.999161 -2.395839 1.167995
C -1.618386 -1.048135 -0.806294
C 0.935223 -0.874280 -0.598310
C -0.620284 0.519173 0.891694
C 3.282482 -0.171286 -0.541876
C -0.687624 2.947622 0.602172
C 4.172830 0.698399 0.338570
C -0.464556 3.937160 -0.535449
H -0.138678 -1.728269 2.165167
H 0.104183 -2.857004 0.782733
H -2.145532 -3.482945 1.293377
H -2.542654 -1.865434 1.972460
H -3.348563 -2.203541 -0.570431
H 3.624976 -1.220933 -0.590898
H 3.195978 0.212457 -1.574093
H -1.722203 2.968408 0.989812
H 0.004403 3.103397 1.449670
H 5.199358 0.715945 -0.070713
H 3.795894 1.734593 0.376988
H 4.215965 0.304798 1.368469
H -0.653466 4.966126 -0.178576
H 0.572219 3.881582 -0.908513
H -1.146652 3.725897 -1.375965


