%chk=000026276.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026276

0 1
 O    4.599400      -1.867400     -0.1710000    
 N   0.9373000      -1.305000     -0.1538000    
 N   -1.926800     -0.2480000      0.8539000    
 C    2.203200      -1.872400      0.2819000    
 C    3.354500      -1.283000     -0.5639000    
 C    2.362300      -1.580600       1.775100    
 C  -0.1775000      -1.899400      0.5851000    
 C    3.510400      0.2157000     -0.4186000    
 C   -1.496300      -1.335000      0.1736000    
 C    2.817200       1.052800      -1.275000    
 C    4.343000      0.7152000      0.5674000    
 C   -2.197100      -1.932400     -0.8544000    
 C   -3.112800      0.2893000      0.5107000    
 C   -3.901800     -0.2498000     -0.5270000    
 C   -3.418700      -1.376500      -1.206000    
 C    2.961100       2.433800      -1.141300    
 C    4.486900       2.096200      0.7012000    
 C    3.795800       2.955500     -0.1531000    
 C   -3.593600       1.408400       1.185200    
 C   -5.135200      0.3365000     -0.8585000    
 C   -4.819700       1.991400      0.8557000    
 C   -5.591700       1.455000     -0.1673000    
 H    2.211300      -2.961500      0.1417000    
 H    3.216800      -1.534200      -1.623600    
 H   0.8135000      -1.480300      -1.151100    
 H  -0.1045000      -1.706900       1.660500    
 H  -0.1883000      -2.990000      0.4601000    
 H    3.393900      -1.755800       2.100500    
 H    2.104400     -0.5483000       2.038500    
 H    1.754300      -2.252800       2.390400    
 H    2.168800      0.6580000      -2.051600    
 H    4.887800      7.3799998E-02   1.253300    
 H    4.517200      -2.830100     -0.2807000    
 H   -1.819200      -2.803200      -1.378700    
 H   -3.991900      -1.826800      -2.013200    
 H    2.424000       3.102800      -1.807100    
 H    5.135200       2.502900       1.471900    
 H    3.907600       4.030700     -4.8599999E-02
 H   -3.007600       1.847500       1.990700    
 H   -5.747400     -7.5599998E-02  -1.657700    
 H   -5.168300       2.864200       1.400200    
 H   -6.545100       1.905200     -0.4263000    


%chk=000026276-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026276

0 1
O 4.383272 -2.045376 -0.553431
N 0.798334 -1.207458 0.117065
N -2.255086 -0.214719 0.927117
C 2.139845 -1.743737 0.453418
C 3.185171 -1.188355 -0.573368
C 2.534511 -1.447263 1.911338
C -0.327561 -1.729864 0.935276
C 3.648856 0.250110 -0.343194
C -1.657405 -1.280037 0.354400
C 2.699438 1.297551 -0.213393
C 5.030075 0.560691 -0.290770
C -2.219176 -1.971058 -0.776686
C -3.456925 0.234738 0.391424
C -4.082803 -0.392756 -0.755852
C -3.420483 -1.527171 -1.328563
C 3.129094 2.631468 -0.037593
C 5.456413 1.897417 -0.114919
C 4.509247 2.939034 0.009283
C -4.091555 1.363766 1.001002
C -5.318557 0.131599 -1.254938
C -5.296683 1.855431 0.492306
C -5.914341 1.236870 -0.642488
H 2.157747 -2.864221 0.321439
H 2.711814 -1.253671 -1.583966
H 0.598236 -1.304639 -0.890748
H -0.246531 -1.329499 1.958621
H -0.311643 -2.848602 0.998003
H 3.599341 -1.700259 2.059267
H 2.392647 -0.377903 2.140522
H 1.938160 -2.044553 2.623651
H 1.631939 1.052074 -0.219381
H 5.756161 -0.250150 -0.389533
H 4.100116 -2.984570 -0.690159
H -1.701773 -2.847188 -1.183348
H -3.868212 -2.038588 -2.188864
H 2.384952 3.429811 0.065524
H 6.528509 2.123640 -0.077270
H 4.840765 3.975439 0.142202
H -3.597906 1.818799 1.865120
H -5.790069 -0.344942 -2.123159
H -5.776674 2.721394 0.961183
H -6.858860 1.636648 -1.027438


