%chk=000149020.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149020

0 1
 O   -1.736100      -1.867800       1.950000    
 O   -2.422900      -1.514500     -0.1049000    
 N  -0.6715000      0.7072000      0.8675000    
 N    3.044500     -0.5627000     -0.5962000    
 N   -4.627200      0.8855000     -0.9039000    
 N   -1.525100      -1.803600      0.7179000    
 C   0.5771000      0.2462000      0.3686000    
 C   0.7943000      -1.101300      6.3600004E-02
 C   -1.721000       1.150600      1.2800000E-02
 C    1.594900       1.188800      0.1909000    
 C   -2.965000       1.508800      0.8253000    
 C    2.060900      -1.466600     -0.4231000    
 C    2.830000      0.7339000     -0.3008000    
 C  -0.2104000      -2.069900      0.2326000    
 C   -4.170300       1.945300     -1.3300000E-02
 C    1.404200       2.549200      0.4893000    
 C    2.283400      -2.806700     -0.7284000    
 C    3.847200       1.667600     -0.4800000    
 C   3.7599999E-02  -3.403100     -8.0100000E-02
 C    1.287100      -3.771800     -0.5617000    
 C    2.437500       3.462400      0.3014000    
 C    3.661400       3.020300     -0.1843000    
 C   -5.810600       1.302200      -1.643100    
 H   -1.393600       2.076800     -0.4796000    
 H   -1.924200      0.4848000     -0.8266000    
 H  -0.5989000       1.172300       1.768900    
 H   -2.716300       2.321500       1.520700    
 H   -3.256800      0.6581000       1.454500    
 H   -3.893900       2.832100     -0.5963000    
 H   -4.976700       2.236400      0.6710000    
 H   0.4663000       2.937400      0.8764000    
 H    3.254300      -3.120800      -1.107300    
 H    4.815500       1.346000     -0.8593000    
 H  -0.7269000      -4.166400      4.3900002E-02
 H    1.491400      -4.809500     -0.8089000    
 H    2.288600       4.512400      0.5339000    
 H   -4.844900      5.1300000E-02 -0.3597000    
 H    4.474400       3.724600     -0.3343000    
 H   -5.602300       2.180300      -2.262900    
 H   -6.646100       1.526800     -0.9721000    
 H   -6.124700      0.4950000      -2.312200    


%chk=000149020-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149020

0 1
O -1.367090 -0.538497 2.056793
O -2.791503 -1.842043 0.837993
N -0.565315 1.588017 0.305512
N 2.961745 -0.520621 -0.755214
N -4.567704 0.248767 -0.703547
N -1.630496 -1.283901 1.033293
C 0.555528 0.798811 0.196204
C 0.541294 -0.612252 -0.120741
C -1.888938 1.405449 -0.332000
C 1.862502 1.418788 0.354395
C -3.061324 1.722254 0.620673
C 1.761546 -1.171350 -0.706723
C 3.027801 0.711159 -0.147102
C -0.549302 -1.541488 0.059441
C -4.425297 1.580549 -0.088961
C 2.050498 2.714750 0.937300
C 1.723451 -2.490242 -1.287925
C 4.316808 1.340218 -0.057027
C -0.553247 -2.826168 -0.493241
C 0.582994 -3.285718 -1.221578
C 3.318949 3.292671 1.028166
C 4.463739 2.600558 0.517945
C -5.839516 0.023157 -1.406962
H -1.945997 2.082389 -1.211586
H -1.992115 0.389713 -0.736004
H -0.396403 2.546589 0.616980
H -2.968819 2.758474 1.005743
H -3.011258 1.050445 1.498085
H -4.511881 2.340554 -0.894252
H -5.234012 1.812796 0.650953
H 1.205416 3.262246 1.374201
H 2.647673 -2.838176 -1.758836
H 5.169131 0.779082 -0.451679
H -1.408624 -3.479019 -0.300544
H 0.573885 -4.287285 -1.662074
H 3.439937 4.274102 1.498699
H -4.327412 -0.510793 -0.050548
H 5.453996 3.063497 0.587643
H -5.921736 0.717222 -2.265488
H -6.748287 0.170441 -0.771696
H -5.865416 -1.006049 -1.806093


