%chk=000098118.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000098118

0 1
 O    5.705100      -1.055700     -0.4344000    
 O   -2.840400      -2.693700     -0.4537000    
 O   -2.531600      -1.095200      -2.081000    
 N   -1.656500       1.229200     -0.8897000    
 C    2.480600       1.893900     -2.6000000E-03
 C    3.217200      0.5863000     -0.3143000    
 C    1.639900       2.426100      -1.181500    
 C    4.049700      0.1244000      0.8901000    
 C    4.809300      -1.200400      0.6697000    
 C   0.6192000       1.414100      -1.729200    
 C   0.9609000       3.741400     -0.7826000    
 C    3.871500      -2.364900      0.3486000    
 C    5.643000      -1.535500       1.910600    
 C  -0.3990000      0.9943000     -0.7009000    
 C   -2.517000      0.8255000      0.1441000    
 C   -3.076000     -0.4505000      0.1490000    
 C   -2.806100       1.722400       1.170200    
 C   -3.928200     -0.8316000       1.185400    
 C   -3.658200       1.341200       2.206700    
 C   -4.219200      6.4300001E-02   2.214300    
 C   -2.789500      -1.406800     -0.9123000    
 C   -2.574500      -3.728700      -1.406400    
 H    1.844000       1.753300      0.8796000    
 H    3.219600       2.657600      0.2734000    
 H    2.489800     -0.1914000     -0.5601000    
 H    3.859100      0.7343000      -1.189300    
 H    2.332200       2.655500      -2.002900    
 H    4.777100      0.9153000       1.116900    
 H    3.395600      2.8500000E-02   1.766300    
 H    1.117700      0.5121000      -2.096600    
 H   9.3699999E-02   1.852400      -2.586500    
 H   0.3790000       4.147300      -1.616800    
 H   0.2870000       3.607100      6.9899999E-02
 H    1.708300       4.491600     -0.5027000    
 H    3.367900      -2.233600     -0.6148000    
 H    4.435200      -3.301300      0.2612000    
 H    3.112000      -2.494900       1.126400    
 H    6.233200      -2.445300       1.751200    
 H    5.012600      -1.679900       2.794000    
 H    6.362200     -0.7362000       2.123000    
 H    5.183300      -1.006000      -1.252600    
 H  -2.5100000E-02  0.4767000      0.2009000    
 H   -2.374500       2.719900       1.173000    
 H   -4.393600      -1.813400       1.214300    
 H   -3.885600       2.039000       3.007200    
 H   -4.885300     -0.2309000       3.019800    
 H   -2.650900      -4.691200     -0.8939000    
 H   -3.313900      -3.698300      -2.212200    
 H   -1.561900      -3.621500      -1.806500    


%chk=000098118-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000098118

0 1
O 4.480404 -1.834924 -1.217610
O -2.005895 -2.769117 -0.078444
O -0.396058 -1.140963 -0.446709
N -1.661245 1.521358 -0.788702
C 2.639317 2.009045 0.105436
C 2.989587 0.590282 -0.401127
C 1.830198 2.885633 -0.894674
C 3.969098 -0.140482 0.545843
C 4.177467 -1.652481 0.231972
C 0.596056 2.160075 -1.500572
C 1.423684 4.226682 -0.238626
C 2.931812 -2.493389 0.601864
C 5.435051 -2.182060 0.941094
C -0.401819 1.640692 -0.495684
C -2.626120 0.903927 0.035657
C -2.654528 -0.504980 0.332550
C -3.710967 1.715843 0.477286
C -3.766405 -1.037024 1.049318
C -4.774817 1.174222 1.217348
C -4.809658 -0.214491 1.504603
C -1.573897 -1.432796 -0.102323
C -0.985582 -3.775205 -0.447228
H 2.085098 1.924756 1.063875
H 3.577505 2.548948 0.349818
H 2.058225 0.001190 -0.507999
H 3.448634 0.669029 -1.408233
H 2.502980 3.112487 -1.748946
H 4.953544 0.366902 0.501097
H 3.607392 -0.048691 1.591116
H 0.940363 1.277275 -2.078570
H 0.070648 2.813010 -2.221942
H 0.918952 4.892802 -0.962720
H 0.727798 4.060965 0.606607
H 2.308336 4.760001 0.156532
H 2.016762 -2.117625 0.106439
H 3.091798 -3.542659 0.294440
H 2.755136 -2.473670 1.693513
H 5.560844 -3.262237 0.750782
H 5.367108 -2.018758 2.031932
H 6.329135 -1.659101 0.559399
H 3.665447 -1.607464 -1.735016
H -0.005227 1.319705 0.485810
H -3.692743 2.777643 0.212326
H -3.784016 -2.112173 1.245043
H -5.585099 1.828014 1.558981
H -5.644490 -0.644622 2.066957
H -1.499933 -4.741917 -0.352751
H -0.641118 -3.610148 -1.482027
H -0.119861 -3.716709 0.234563


