%chk=000091344.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091344

1 1
 O   -3.899500      0.4705000     -9.1399997E-02
 O   -2.861500      -1.587900     -1.6100001E-02
 N   -7.592800      0.2096000      8.2099997E-02
 C   -6.272400      0.8782000     -3.5100002E-02
 C    3.515200      0.4568000     -0.1276000    
 C    4.769800     -0.4178000     -8.8399999E-02
 C    2.245300     -0.3917000     -2.9300001E-02
 C    6.074600      0.3847000     -9.0899996E-02
 C   0.9883000      0.4776000     -0.1012000    
 C    7.366300     -0.4310000      3.5300002E-02
 C   -8.727200       1.243100      9.7000003E-02
 C   -7.675400     -0.6089000       1.377700    
 C   -7.828600     -0.7412000      -1.099300    
 C  -0.2814000     -0.3771000     -3.7000000E-02
 C   -5.177200     -0.1700000     -1.5400000E-02
 C    8.628700      0.4330000      8.7399997E-02
 C   -1.555700      0.4614000     -0.1347000    
 C    9.921600     -0.3863000      0.1230000    
 C   -2.820300     -0.3671000     -8.2400002E-02
 C    11.18230      0.4641000      0.1464000    
 H   -6.247300       1.459400     -0.9649000    
 H   -6.156200       1.582700      0.7977000    
 H    3.540300       1.173700      0.7019000    
 H    3.505100       1.037700      -1.057500    
 H    4.767500      -1.100800     -0.9466000    
 H    4.744700      -1.043000      0.8128000    
 H    2.249500     -0.9551000      0.9117000    
 H    2.231400      -1.124500     -0.8452000    
 H    6.120100      0.9775000      -1.013300    
 H    6.040400       1.105200      0.7365000    
 H   0.9887000       1.197800      0.7258000    
 H   0.9926000       1.054600      -1.033900    
 H    7.315700      -1.047900      0.9407000    
 H    7.432100      -1.121100     -0.8146000    
 H   -9.683000      0.7174000      0.1792000    
 H   -8.680300       1.811800     -0.8363000    
 H   -8.575200       1.901600      0.9572000    
 H   -7.065300      -1.511300       1.291400    
 H   -8.718600     -0.9071000       1.523700    
 H   -7.346300      2.2399999E-02   2.208200    
 H   -8.872300      -1.070000      -1.066600    
 H   -7.181800      -1.617000      -1.009900    
 H   -7.635300     -0.1945000      -2.026800    
 H  -0.2686000      -1.113100     -0.8508000    
 H  -0.2920000     -0.9490000      0.8995000    
 H   -5.246300     -0.8461000     -0.8724000    
 H   -5.179500     -0.7511000      0.9107000    
 H    8.649000       1.091900     -0.7895000    
 H    8.586500       1.082500      0.9703000    
 H   -1.557200       1.018100      -1.078600    
 H   -1.582900       1.175200      0.6967000    
 H    9.914900      -1.034600       1.007400    
 H    9.957800      -1.045000     -0.7530000    
 H    11.19980       1.110700       1.029200    
 H    11.24210       1.097300     -0.7444000    
 H    12.07130     -0.1736000      0.1723000    


%chk=000091344-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091344

1 1
O -3.976857 0.323323 0.056749
O -2.935433 -1.750671 0.221715
N -7.761476 0.239779 -0.019995
C -6.285488 0.706257 -0.020656
C 3.582403 0.407299 0.030364
C 4.889227 -0.417128 0.003644
C 2.309515 -0.468749 0.033853
C 6.162676 0.458309 0.000541
C 1.003939 0.357593 0.065249
C 7.470577 -0.364728 -0.023862
C -8.642431 1.486559 -0.142373
C -8.104554 -0.482902 1.283630
C -8.042062 -0.682804 -1.207584
C -0.262268 -0.526935 0.069842
C -5.251056 -0.421340 0.095662
C 8.744000 0.510843 -0.025731
C -1.552726 0.318279 0.102888
C 10.052589 -0.312038 -0.050352
C -2.810716 -0.515800 0.135997
C 11.318933 0.571258 -0.050763
H -6.125437 1.262040 -0.960039
H -6.170452 1.406154 0.824327
H 3.581588 1.061042 0.927664
H 3.560397 1.085278 -0.848493
H 4.892793 -1.071319 -0.893226
H 4.913581 -1.094974 0.882433
H 2.335283 -1.148152 0.910987
H 2.311179 -1.120331 -0.864547
H 6.140682 1.135557 -0.878926
H 6.159924 1.113478 0.896844
H 1.007255 1.008353 0.964825
H 0.982329 1.037089 -0.812500
H 7.493893 -1.042402 0.855256
H 7.475487 -1.019545 -0.920435
H -9.700082 1.182222 -0.138965
H -8.405298 2.004326 -1.084180
H -8.442096 2.153274 0.710011
H -7.530858 -1.417983 1.349092
H -9.181521 -0.710078 1.289806
H -7.854713 0.171361 2.132684
H -9.120353 -0.901674 -1.239478
H -7.480479 -1.620148 -1.089357
H -7.735114 -0.176091 -2.135149
H -0.267690 -1.176627 -0.826290
H -0.242732 -1.205320 0.943782
H -5.283476 -1.139637 -0.743536
H -5.319399 -0.986571 1.042788
H 8.723335 1.188837 -0.904743
H 8.741819 1.165612 0.870945
H -1.607481 0.996996 -0.770890
H -1.561076 0.982318 0.991153
H 10.072890 -0.989936 0.827411
H 10.054964 -0.965193 -0.946924
H 11.356817 1.210178 0.851753
H 11.336863 1.237897 -0.933645
H 12.239884 -0.039736 -0.070557


