%chk=000036039.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036039

0 1
 N   0.6148000      0.7184000     -0.9722000    
 N   0.3716000      -1.863700      0.4927000    
 N   -1.787300       2.818700      0.5495000    
 C   0.6051000       2.160400      -1.174100    
 C  -0.2929000     -8.9299999E-02  -1.774000    
 C    1.704900      7.6200001E-02 -0.3855000    
 C   -1.333300     -0.7395000     -0.9087000    
 C   0.6599000       2.894200      0.1654000    
 C    1.588100      -1.175000      0.2686000    
 C  -0.9639000      -1.616000      0.1224000    
 C  -0.4780000       2.546200       1.130000    
 C    2.988000      0.6723000     -0.4313000    
 C   -2.694200     -0.5132000      -1.180900    
 C    2.751000      -1.785300      0.7975000    
 C   -1.983500      -2.244600      0.8638000    
 C    4.118700      5.5900000E-02  0.1066000    
 C    4.001500      -1.180500      0.7162000    
 C   -3.686900      -1.143800     -0.4344000    
 C   -3.331300      -2.012700      0.5887000    
 C   -2.852100       2.421300       1.459700    
 H    1.428100       2.477100      -1.825100    
 H  -0.3001000       2.470500      -1.709900    
 H   0.2500000     -0.8593000      -2.339900    
 H  -0.7782000      0.5285000      -2.540200    
 H   0.6315000       3.972900     -3.8600001E-02
 H    1.611000       2.718000      0.6789000    
 H   0.4767000      -2.690400       1.075100    
 H  -0.3494000       3.147800       2.038200    
 H  -0.3999000       1.494200       1.428600    
 H    3.151000       1.627900     -0.9232000    
 H   -2.989600      0.1570000      -1.984700    
 H    2.678800      -2.749200       1.299500    
 H   -1.728200      -2.921500       1.677100    
 H    5.087300      0.5422000      3.8300000E-02
 H    4.874400      -1.671100       1.135500    
 H   -4.733900     -0.9586000     -0.6543000    
 H   -1.897400       2.299300     -0.3198000    
 H   -4.099000      -2.507800       1.175700    
 H   -2.812000       1.350900       1.685900    
 H   -3.822500       2.631300      0.9995000    
 H   -2.803000       2.986200       2.396200    


%chk=000036039-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000036039

0 1
N 0.593827 0.733583 -0.994892
N 0.307412 -1.833512 0.473631
N -1.718427 2.561625 0.678632
C 0.565980 2.193845 -1.216399
C -0.286532 -0.120471 -1.837219
C 1.706494 0.102186 -0.394381
C -1.386931 -0.792262 -1.042402
C 0.675608 3.030252 0.081086
C 1.548852 -1.171704 0.253933
C -1.024202 -1.613214 0.066435
C -0.324901 2.610609 1.180033
C 3.000574 0.692814 -0.411532
C -2.749378 -0.643622 -1.379503
C 2.695445 -1.808145 0.803847
C -2.052166 -2.297395 0.779305
C 4.118565 0.065572 0.175789
C 3.967674 -1.203204 0.778498
C -3.770289 -1.307746 -0.659543
C -3.405791 -2.146244 0.419429
C -2.743002 2.569850 1.743388
H 1.349984 2.526008 -1.936715
H -0.407744 2.428359 -1.682883
H 0.336379 -0.893437 -2.334092
H -0.723783 0.498554 -2.640655
H 0.488549 4.085303 -0.198010
H 1.698983 2.971206 0.498224
H 0.398394 -2.608652 1.134632
H -0.283560 3.362726 1.992060
H 0.000987 1.639178 1.623694
H 3.129472 1.658295 -0.910829
H -3.011561 -0.007235 -2.234639
H 2.573365 -2.787699 1.286409
H -1.783593 -2.941010 1.627508
H 5.096901 0.557062 0.149390
H 4.824245 -1.715336 1.228825
H -4.821452 -1.178856 -0.936058
H -1.847354 1.743384 0.065969
H -4.176263 -2.678219 0.988794
H -2.628735 1.756376 2.501486
H -3.745738 2.471170 1.290173
H -2.710486 3.535907 2.281382


