%chk=000132755.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132755

0 1
 O    2.755400      -1.318000       1.564300    
 O   0.6010000      5.8499999E-02  -1.425000    
 O   -1.902800      -1.202300      -1.628800    
 N    2.469400      0.6579000      0.3937000    
 N  -0.9871000     -0.2081000      0.2691000    
 N   -4.346200     -0.5052000     -0.1388000    
 C    1.080100      0.9062000      0.7561000    
 C   0.9281000       2.421600      0.6924000    
 C    3.098800       1.864000     -0.1382000    
 C    1.950900       2.836900     -0.3623000    
 C    4.310300     -0.8524000     -0.1775000    
 C    3.112300     -0.5359000      0.6816000    
 C   0.2269000      0.2178000     -0.2664000    
 C    3.862700     -0.9308000      -1.638200    
 C    4.898800      -2.191200      0.2706000    
 C    5.331900      0.2702000      9.3000000E-03
 C   -3.191000      -1.196900      0.4275000    
 C   -1.977500     -0.8912000     -0.4421000    
 C   -4.092600      0.9334000     -0.2222000    
 C   -3.444500      -2.698600      0.4707000    
 C   -5.543100     -0.7659000      0.6611000    
 C   -5.259800       1.614600     -0.9295000    
 C   -3.881900       1.515200       1.172800    
 H   0.8816000      0.5112000       1.758200    
 H  -8.3899997E-02   2.753200      0.4408000    
 H    1.204700       2.863200       1.657600    
 H    3.777200       2.273100      0.6163000    
 H    3.599400       1.729100      -1.091800    
 H    2.259700       3.881600     -0.2654000    
 H    1.527000       2.701600      -1.364700    
 H    3.394900     -3.0099999E-02  -2.036500    
 H    3.130000      -1.737000      -1.769700    
 H    4.715700      -1.161100      -2.287600    
 H    4.168100      -3.004100      0.1826000    
 H    5.230700      -2.156500       1.315100    
 H    5.765500      -2.465700     -0.3419000    
 H    5.263200      0.7660000      0.9834000    
 H    6.343500     -0.1607000     -7.1000000E-03
 H    5.374500       1.000800     -0.8012000    
 H   -1.156200     -1.0100000E-02   1.251300    
 H   -2.994800     -0.9075000       1.465700    
 H   -3.214000       1.149100     -0.8402000    
 H   -2.510300      -3.235400      0.6751000    
 H   -4.150100      -2.981300       1.258600    
 H   -3.820100      -3.077000     -0.4875000    
 H   -5.400100     -0.6158000       1.737000    
 H   -6.420300     -0.1957000      0.3450000    
 H   -5.864500      -1.805300      0.5246000    
 H   -6.143200       1.744200     -0.2965000    
 H   -4.959900       2.623600      -1.238300    
 H   -5.550300       1.078900      -1.840400    
 H   -3.016300       1.121600       1.707600    
 H   -4.760300       1.434000       1.820500    
 H   -3.692100       2.592500       1.075400    


%chk=000132755-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000132755

0 1
O 0.923655 -0.000560 1.190686
O -0.270654 2.539198 -2.295793
O -2.564869 0.689477 -2.269079
N 2.210969 1.239366 -0.251720
N -0.824617 0.896935 -0.681959
N -3.845547 -0.749366 0.077265
C 1.152959 2.315528 -0.279762
C 1.903693 3.547457 -0.816639
C 3.406781 1.656905 -1.050140
C 2.938567 2.930445 -1.788018
C 3.114719 -0.989680 0.665971
C 2.039839 0.132503 0.555547
C -0.051152 1.939448 -1.214383
C 3.094469 -1.811845 -0.660168
C 2.697571 -1.926699 1.832202
C 4.550485 -0.466695 0.962784
C -2.455633 -0.941537 -0.410574
C -1.993242 0.300882 -1.224740
C -4.055020 0.535945 0.822128
C -2.333066 -2.160980 -1.357889
C -4.387205 -1.945392 0.755595
C -5.555063 0.897096 0.884533
C -3.406516 0.580648 2.236826
H 0.765144 2.440007 0.748277
H 1.217243 4.237451 -1.330170
H 2.404995 4.077949 0.013302
H 4.246950 1.891493 -0.372171
H 3.724060 0.858616 -1.741475
H 3.783028 3.604738 -2.006674
H 2.439152 2.673965 -2.737698
H 3.376871 -1.208539 -1.541132
H 2.089817 -2.234688 -0.841382
H 3.810561 -2.650298 -0.582202
H 1.671362 -2.302458 1.696148
H 2.729509 -1.396277 2.799967
H 3.394603 -2.783909 1.876954
H 4.548788 0.282812 1.775608
H 5.173011 -1.316730 1.296346
H 5.046295 -0.030585 0.081042
H -0.423764 0.488408 0.194107
H -1.739119 -1.092154 0.439476
H -3.574711 1.317171 0.201721
H -1.318740 -2.203068 -1.795440
H -2.505213 -3.110988 -0.824808
H -3.063513 -2.059589 -2.177999
H -3.765250 -2.302337 1.614327
H -5.397485 -1.723836 1.136123
H -4.487504 -2.777662 0.039293
H -6.115985 0.245178 1.579959
H -5.679930 1.937211 1.237885
H -6.003043 0.810247 -0.120044
H -2.323788 0.356124 2.206136
H -3.887500 -0.144280 2.919604
H -3.527568 1.587148 2.678450


