%chk=000124560.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124560

0 1
 O    3.902500      -1.026600      0.8529000    
 O    4.298700       2.121500     -0.4108000    
 O   -1.199100      -3.074700     -0.3514000    
 O   -4.371000      0.2490000     -0.1387000    
 N  -0.4705000     -0.8810000     -2.4200000E-02
 N   -2.770400      -1.407300     -0.2438000    
 C    2.486100      0.5665000     -0.3507000    
 C   0.9229000      -1.250200      2.0800000E-02
 C    1.733200     -0.5504000      -1.077700    
 C    2.843100     -8.6099997E-02  0.9862000    
 C    1.566900     -0.8391000       1.357100    
 C    3.669600       1.088400      -1.149900    
 C  -0.8351000      0.4512000      0.1216000    
 C   -1.451900      -1.875700     -0.2159000    
 C   -2.097900      0.8927000      9.4200000E-02
 C   -3.191900     -9.3300000E-02 -0.1042000    
 C   -2.393400       2.274100      0.2512000    
 C   -2.641600       3.440800      0.3832000    
 H    1.834100       1.421300     -0.1541000    
 H    1.024400      -2.333500     -0.1106000    
 H    1.123300     -0.1673000      -1.903100    
 H    2.447100      -1.264300      -1.508900    
 H    3.127100      0.6490000       1.745600    
 H   0.9178000     -0.1959000       1.961500    
 H    1.779700      -1.729200       1.960700    
 H    3.345800       1.497100      -2.112800    
 H    4.410000      0.3074000      -1.348500    
 H    4.056600      -1.419600       1.728900    
 H  -4.4900000E-02   1.165500      0.2898000    
 H    3.649600       2.834900     -0.2873000    
 H   -3.495800      -2.105800     -0.3809000    
 H   -2.861900       4.476200      0.5004000    


%chk=000124560-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124560

0 1
O 3.772331 -1.383622 0.569303
O 4.986244 1.788601 -0.342932
O -1.019130 -3.053408 -0.179227
O -4.665635 -0.141132 -0.035652
N -0.572027 -0.739383 -0.017434
N -2.797947 -1.535165 -0.108801
C 2.772692 0.642416 -0.291052
C 0.901255 -0.983150 -0.001263
C 1.693253 -0.159690 -1.076732
C 2.987180 -0.205391 0.986612
C 1.553736 -0.626983 1.370365
C 4.058777 0.916620 -1.085373
C -1.076455 0.546494 0.074451
C -1.435827 -1.866344 -0.107547
C -2.428390 0.855568 0.075862
C -3.411321 -0.248568 -0.023322
C -2.888644 2.202717 0.170022
C -3.307791 3.361111 0.250660
H 2.344345 1.614445 0.038110
H 1.008383 -2.060670 -0.194701
H 1.030096 0.492113 -1.672327
H 2.182114 -0.858637 -1.777108
H 3.514978 0.351802 1.783842
H 1.030212 0.226429 1.844123
H 1.524582 -1.473918 2.077614
H 3.814501 1.351388 -2.078215
H 4.612285 -0.024301 -1.226384
H 3.991950 -1.929800 1.364019
H -0.333434 1.345112 0.144159
H 4.600082 2.699664 -0.292849
H -3.439899 -2.331846 -0.177316
H -3.689397 4.363129 0.319695


