%chk=000043131.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043131

0 1
 O   0.8199000      4.8300002E-02   1.912700    
 N   -3.155400      0.1642000      0.1548000    
 C   -3.705300       1.441800     -0.2978000    
 C   -3.948400     -0.8550000     -0.5319000    
 C   -5.206600       1.195600     -0.2718000    
 C   -5.366300     -0.3141000     -0.4220000    
 C   -1.732200      4.1900001E-02 -0.1239000    
 C   -1.207100      -1.301400      0.3870000    
 C   0.2902000      -1.479000      0.1207000    
 C    1.158200     -0.4611000      0.8470000    
 C    2.472900     -8.9100003E-02  0.2508000    
 C    3.146600      -1.024100     -0.5028000    
 C    2.964500       1.177600      0.4749000    
 C    4.375800     -0.6743000      -1.061700    
 C    4.193800       1.527300     -8.3899997E-02
 C    4.899500      0.6015000     -0.8522000    
 H   -3.387600       1.682100      -1.320600    
 H   -3.421400       2.269900      0.3592000    
 H   -3.887100      -1.839700     -5.8600001E-02
 H   -3.668600     -0.9502000      -1.588900    
 H   -5.716300       1.739000      -1.073900    
 H   -5.638400       1.521000      0.6820000    
 H   -5.872900     -0.7222000      0.4606000    
 H   -5.964100     -0.5729000      -1.301900    
 H   -1.525100      0.1367000      -1.197800    
 H   -1.203600      0.8598000      0.3786000    
 H   -1.403600      -1.393400       1.462800    
 H   -1.715200      -2.137000     -0.1069000    
 H   0.4601000      -1.406000     -0.9595000    
 H   0.5993000      -2.476500      0.4530000    
 H    2.769200      -2.028100     -0.6670000    
 H    2.423200       1.910000       1.066000    
 H    4.927400      -1.396300      -1.656900    
 H    4.601000       2.521100      7.8100003E-02
 H    5.856800      0.8736000      -1.286800    


%chk=000043131-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043131

0 1
O 0.719441 0.891173 1.316784
N -3.353091 0.126716 0.040569
C -4.065583 1.361348 -0.375992
C -4.168545 -0.994561 -0.497739
C -5.543723 1.024519 -0.082895
C -5.644498 -0.512584 -0.361634
C -1.922379 0.098617 -0.314104
C -1.158857 -1.037382 0.399865
C 0.323245 -1.117406 -0.016577
C 1.195638 0.019721 0.530782
C 2.646788 0.072908 0.128960
C 3.240389 -0.891523 -0.730307
C 3.449458 1.130763 0.637258
C 4.606662 -0.798575 -1.072247
C 4.812481 1.224277 0.294888
C 5.395500 0.258682 -0.561809
H -3.926450 1.576452 -1.468645
H -3.694362 2.232909 0.191892
H -3.975494 -1.927713 0.060356
H -3.923365 -1.188163 -1.575675
H -6.237046 1.616763 -0.705497
H -5.769073 1.234396 0.976762
H -6.161352 -1.027215 0.466130
H -6.208950 -0.723274 -1.287180
H -1.782043 -0.006890 -1.426270
H -1.475461 1.062584 -0.012718
H -1.236826 -0.872365 1.489423
H -1.639549 -2.008562 0.173523
H 0.411473 -1.134435 -1.123016
H 0.766138 -2.073450 0.332529
H 2.643598 -1.716269 -1.133459
H 2.974363 1.862721 1.299099
H 5.056700 -1.546585 -1.734191
H 5.422080 2.043548 0.691469
H 6.455893 0.329854 -0.828935


