%chk=000114190.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114190

0 1
 O    5.144200       2.316000     -0.9142000    
 N   -1.439600     -0.8618000     -0.9295000    
 C    1.639600      -1.193100     -0.5513000    
 C   0.5229000      -1.410800      0.4720000    
 C  -0.4783000     -0.3157000      2.4900001E-02
 C   0.9265000      -1.399000      -1.975000    
 C    2.727900      -2.270300     -0.3259000    
 C   0.9981000      -1.450600       1.936300    
 C    2.145700      0.2884000     -0.3168000    
 C  -0.1668000      0.9916000      0.7399000    
 C  -0.6512000      -1.719000      -1.895800    
 C    3.222700      -2.336500       1.123300    
 C    2.072700      -2.524200       2.111400    
 C    1.319700       1.281800      0.3562000    
 C   -2.533900      -1.579100     -0.2970000    
 C    3.419300      0.6757000     -0.7528000    
 C    1.826800       2.560200      0.6120000    
 C   -3.256800     -0.6634000      0.6935000    
 C    3.896400       1.963800     -0.4941000    
 C   -3.882000      0.6090000      7.2099999E-02
 C    3.112700       2.893100      0.1920000    
 C   -4.878500      0.3162000      -1.069700    
 C   -4.522800       1.488400       1.169300    
 C   -6.103300     -0.4764000     -0.6325000    
 C   -5.061800       2.815700      0.6516000    
 H   9.1799997E-02  -2.412000      0.3315000    
 H  -0.1196000      0.2044000     -0.8755000    
 H    1.401300      -2.224200      -2.519600    
 H    1.068300     -0.5036000      -2.594800    
 H    3.579600      -2.126700     -0.9991000    
 H    2.312500      -3.255300     -0.5807000    
 H   0.1464000      -1.673100       2.589900    
 H    1.415500     -0.5011000       2.282700    
 H  -0.2968000      0.9285000       1.824000    
 H  -0.8037000       1.804100      0.3683000    
 H   -1.082000      -1.593400      -2.895700    
 H  -0.7560000      -2.781600      -1.639500    
 H    3.776200      -1.424600       1.374800    
 H    3.928300      -3.168900       1.226900    
 H    1.626000      -3.515500       1.965700    
 H    2.457800      -2.497600       3.137000    
 H   -3.232800      -1.947500      -1.055200    
 H   -2.177300      -2.462600      0.2468000    
 H    4.058100     -1.7100001E-02  -1.292500    
 H    1.217700       3.304600       1.117200    
 H   -2.583700     -0.3769000       1.511100    
 H   -4.046200      -1.250200       1.180300    
 H   -3.070900       1.202200     -0.3692000    
 H    3.490400       3.892800      0.3915000    
 H   -4.373100     -0.2303000      -1.873700    
 H   -5.208300       1.252900      -1.532800    
 H   -3.757800       1.709400       1.924900    
 H   -5.318500      0.9467000       1.692900    
 H    5.316900       3.237100     -0.6541000    
 H   -6.752500     -0.6540000      -1.496800    
 H   -5.831600      -1.453800     -0.2245000    
 H   -6.695800      6.2300000E-02  0.1119000    
 H   -4.305700       3.348700      6.6600002E-02
 H   -5.347800       3.454500       1.493900    
 H   -5.952900       2.678200      3.2800000E-02


%chk=000114190-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000114190

0 1
O 5.337140 2.140510 -0.976812
N -1.479464 -0.772269 -0.886058
C 1.668068 -1.200246 -0.574345
C 0.548294 -1.354579 0.474650
C -0.359537 -0.203136 -0.089251
C 0.874003 -1.405242 -1.974217
C 2.773601 -2.269825 -0.377873
C 1.046414 -1.386682 1.935499
C 2.184761 0.280915 -0.326992
C -0.112862 1.066163 0.737211
C -0.695648 -1.685586 -1.859104
C 3.275079 -2.327699 1.088173
C 2.103346 -2.512375 2.087604
C 1.400628 1.286556 0.386497
C -2.549840 -1.514306 -0.179726
C 3.483231 0.633009 -0.753143
C 1.985235 2.544490 0.642546
C -3.362146 -0.609665 0.769924
C 4.033488 1.908175 -0.492579
C -4.011792 0.642525 0.117722
C 3.294255 2.873216 0.223021
C -4.917713 0.294411 -1.097494
C -4.743514 1.470605 1.211147
C -6.136809 -0.604020 -0.785393
C -5.292231 2.831497 0.729225
H 0.043007 -2.328531 0.317032
H 0.163871 0.184543 -0.972889
H 1.302454 -2.285372 -2.494987
H 1.051341 -0.538879 -2.639035
H 3.622939 -2.122419 -1.073139
H 2.328624 -3.252707 -0.640154
H 0.195745 -1.566191 2.622835
H 1.507939 -0.427748 2.234203
H -0.279827 0.966176 1.825868
H -0.697620 1.933958 0.376228
H -1.139383 -1.590016 -2.869283
H -0.828805 -2.745849 -1.546158
H 3.818883 -1.393458 1.330601
H 4.000552 -3.157262 1.198596
H 1.622565 -3.497163 1.907529
H 2.492166 -2.531270 3.124334
H -3.216564 -1.951389 -0.948764
H -2.143926 -2.378032 0.411583
H 4.107983 -0.083897 -1.294246
H 1.392032 3.301256 1.170303
H -2.698963 -0.269501 1.592192
H -4.146051 -1.232658 1.247881
H -3.185431 1.266605 -0.282611
H 3.714476 3.864390 0.436976
H -4.290447 -0.190067 -1.870353
H -5.275376 1.238236 -1.554458
H -4.032197 1.646821 2.045004
H -5.571407 0.869841 1.641209
H 5.637266 3.054791 -0.747452
H -6.719561 -0.803311 -1.703890
H -5.830873 -1.581924 -0.369351
H -6.819543 -0.129063 -0.056563
H -4.491942 3.437198 0.262427
H -5.708004 3.413646 1.572736
H -6.097908 2.709206 -0.017534


