%chk=000036660.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036660

0 1
 O    3.605600       1.717900      2.1600001E-02
 O   -1.849000       1.766000     -0.8401000    
 O   -4.548900       1.703700     -0.8703000    
 N   0.1108000      -2.497600     -0.2493000    
 N   -3.817000       1.015400      0.1066000    
 C  -0.7621000     -0.6209000      0.5529000    
 C   0.6050000     -0.3781000      0.2415000    
 C    1.129300      -1.571400     -0.2598000    
 C   -1.036200      -1.932300      0.2399000    
 C   -1.717600      0.3581000       1.111900    
 C    1.449300      0.7458000      0.3383000    
 C    2.461200      -1.697500     -0.6706000    
 C   -2.280600      -2.717200      0.3563000    
 C    2.783700      0.6345000     -6.8800002E-02
 C    3.279800     -0.5693000     -0.5653000    
 C   -2.451300       1.122900      1.7600000E-02
 C    3.038100       2.920000      0.5376000    
 H   0.2022000      -3.455400     -0.5591000    
 H   -2.434700     -0.1456000       1.771200    
 H   -1.203400       1.097700       1.737200    
 H    1.012200       1.656300      0.7294000    
 H    2.848100      -2.634300      -1.057200    
 H   -2.559200      -2.837400       1.408200    
 H   -3.103400      -2.212400     -0.1601000    
 H   -2.177000      -3.716100     -7.9999998E-02
 H    4.319100     -0.6400000     -0.8778000    
 H   -4.335600      0.3956000      0.7182000    
 H    3.830300       3.675800      0.5396000    
 H    2.711700       2.798800       1.576100    
 H    2.239000       3.298800     -0.1088000    
 H   -4.743700       2.526800     -0.3909000    


%chk=000036660-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000036660

0 1
O 3.285673 1.837183 -0.366242
O -3.497913 1.974842 1.217523
O -2.949405 2.302270 -1.350884
N -0.057324 -2.633753 -0.206295
N -2.281953 1.287441 -0.582758
C -0.941671 -0.791211 0.803045
C 0.373102 -0.447448 0.285581
C 0.904572 -1.623231 -0.344739
C -1.173601 -2.138588 0.484015
C -1.878886 0.113933 1.562073
C 1.142397 0.751382 0.302020
C 2.178807 -1.634599 -0.954596
C -2.362315 -3.012789 0.779535
C 2.414255 0.732414 -0.307350
C 2.928152 -0.447365 -0.930812
C -2.608040 1.181158 0.740305
C 2.828661 3.083148 0.248630
H 0.032589 -3.586670 -0.552644
H -2.667645 -0.468863 2.071997
H -1.342099 0.659008 2.363654
H 0.748988 1.653806 0.779271
H 2.582217 -2.533238 -1.433763
H -2.538556 -3.103005 1.867424
H -3.286898 -2.606567 0.330038
H -2.221959 -4.033741 0.382472
H 3.921015 -0.393745 -1.386711
H -1.570038 0.778288 -1.105209
H 3.646398 3.801581 0.090154
H 2.650401 2.955112 1.334790
H 1.904740 3.457500 -0.235024
H -3.557966 2.694348 -0.639499


