%chk=000002399.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002399

0 1
 O   -2.288300      -3.149700     -0.8279000    
 O    2.289100      -3.151200     -0.7737000    
 N   -2.951100      0.4269000       1.983800    
 N    2.877700      0.4651000       2.033100    
 N   2.4999999E-03  -3.497100     -0.9881000    
 C  -0.6819000      -1.579100      4.0899999E-02
 C   0.6636000      -1.585000      6.7000002E-02
 C   -1.598100     -0.6146000      0.5654000    
 C    1.568000     -0.6119000      0.5960000    
 C   -2.136700      0.5274000     -9.0800002E-02
 C    2.145200      0.5055000     -7.3799998E-02
 C   -2.982200       1.163200      0.8209000    
 C    2.961300       1.163000      0.8493000    
 C   -1.129100      -2.820700     -0.6406000    
 C    1.125900      -2.827000     -0.6036000    
 C   -2.117300     -0.6492000       1.839100    
 C    2.039400     -0.6079000       1.890500    
 C   -1.985600       1.082900      -1.376800    
 C    2.049600       1.020500      -1.381800    
 C   -3.687000       2.331500      0.5095000    
 C    3.689400       2.314200      0.5285000    
 C   -2.684300       2.251100      -1.702400    
 C    2.772300       2.171300      -1.717200    
 C   -3.521400       2.864100     -0.7722000    
 C    3.578900       2.806600     -0.7751000    
 H   -1.970900      -1.340200       2.658200    
 H    1.855000      -1.270700       2.725100    
 H   -3.468900      0.6496000       2.822600    
 H    3.364900      0.7102000       2.883900    
 H   8.0000004E-03  -4.387300      -1.472900    
 H   -1.338300      0.6171000      -2.114500    
 H    1.426400      0.5370000      -2.128700    
 H   -4.338700       2.809400       1.233000    
 H    4.317600       2.809500       1.261200    
 H   -2.571700       2.683900      -2.693000    
 H    2.702300       2.572800      -2.724700    
 H   -4.054600       3.770900      -1.046300    
 H    4.131400       3.699200      -1.057000    


%chk=000002399-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000002399

0 1
O -1.965067 -3.851388 -0.082770
O 2.407197 -2.650864 -1.236415
N -3.900804 -0.473294 1.614962
N 1.871966 1.781231 1.320443
N 0.279283 -3.560577 -0.774266
C -0.761621 -1.662877 0.106117
C 0.560870 -1.310282 -0.186775
C -1.892361 -0.892269 0.598533
C 1.290470 -0.094301 0.144726
C -2.229284 0.520918 0.405346
C 2.428870 0.545533 -0.526484
C -3.490700 0.750366 1.059085
C 2.758512 1.723235 0.232283
C -0.945774 -3.125429 -0.229553
C 1.236047 -2.517170 -0.799222
C -2.960065 -1.453313 1.328358
C 0.995028 0.708835 1.263949
C -1.632311 1.597755 -0.302818
C 3.183977 0.269180 -1.697322
C -4.141117 2.001365 1.057942
C 3.793620 2.611271 -0.129697
C -2.276336 2.852367 -0.311769
C 4.215266 1.153014 -2.071021
C -3.511653 3.057607 0.366418
C 4.521375 2.310588 -1.298206
H -3.093233 -2.487694 1.634053
H 0.225448 0.563641 2.018093
H -4.766899 -0.626188 2.127436
H 1.864293 2.506470 2.034701
H 0.455620 -4.504404 -1.117340
H -0.694853 1.456738 -0.846685
H 2.987047 -0.633735 -2.278509
H -5.103520 2.149641 1.560267
H 4.024022 3.500099 0.468228
H -1.821515 3.685500 -0.858717
H 4.803538 0.941497 -2.970612
H -3.986784 4.044340 0.339127
H 5.333849 2.973893 -1.614987


