%chk=000085965.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085965

0 1
 O    5.567100     -0.9691000      6.0100000E-02
 N    5.948900       1.262900     -3.7400000E-02
 C    3.626300      0.3773000      5.2900001E-02
 C    5.060500      0.2952000      2.2200000E-02
 C   -5.697300     -0.1657000     -4.9800001E-02
 C   0.8360000      0.5378000      0.1084000    
 C   -2.931900     -0.3102000     -0.1382000    
 C    6.918100     -0.7746000      2.0500001E-02
 C    7.147900      0.5920000     -3.9299998E-02
 C   -7.141400     -9.0400003E-02 -3.5000001E-03
 C    2.856200     -0.7872000      0.1170000    
 C    2.992800       1.622700      1.6799999E-02
 C    1.464000     -0.7072000      0.1446000    
 C    1.600400       1.702900      4.4399999E-02
 C   -4.928000      0.7448000      0.6744000    
 C   -5.074600      -1.149000     -0.8186000    
 C  -0.6159000      0.6206000      0.1360000    
 C   -3.535700      0.6722000      0.6299000    
 C   -3.682300      -1.221800     -0.8631000    
 C   -1.461100     -0.3874000     -0.1847000    
 C    7.912600      -1.744900      3.5300002E-02
 C    8.470500       1.055300     -8.9299999E-02
 C   -7.846100     -0.8013000      0.9681000    
 C   -7.829400      0.6933000     -0.9301000    
 C    9.226200      -1.266000     -1.5100000E-02
 C    9.502300      0.1055000     -7.6200001E-02
 C   -9.238300     -0.7287000       1.013100    
 C   -9.221700      0.7661000     -0.8849000    
 C   -9.926000      5.5000000E-02  8.6800002E-02
 H    3.307800      -1.775600      0.1515000    
 H    3.567600       2.544500     -3.3900000E-02
 H   0.9125000      -1.639900      0.2170000    
 H    1.129100       2.682300      1.3700000E-02
 H   -5.398100       1.514200       1.282400    
 H   -5.659600      -1.866400      -1.389400    
 H   -1.003500       1.593400      0.4258000    
 H   -2.978000       1.386400       1.227000    
 H   -3.212200      -1.992800      -1.467800    
 H   -1.078100      -1.345600     -0.5256000    
 H    7.688400      -2.803100      8.2599998E-02
 H    8.695800       2.115500     -0.1368000    
 H   -7.325600      -1.416900       1.698100    
 H   -7.295800       1.254000      -1.694000    
 H    10.05090      -1.974800     -6.6999998E-03
 H    10.53560      0.4412000     -0.1142000    
 H   -9.787000      -1.282300       1.769600    
 H   -9.757500       1.376200      -1.606100    
 H   -11.01010      0.1115000      0.1218000    


%chk=000085965-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000085965

0 1
O 5.796367 -0.946469 -0.551467
N 6.065075 1.016883 0.665287
C 3.731771 0.223160 0.158266
C 5.185090 0.170149 0.134717
C -5.859616 -0.113924 -0.076066
C 0.871319 0.364746 0.232415
C -2.975542 -0.248395 -0.151274
C 7.179725 -0.716062 -0.397297
C 7.340790 0.488596 0.349220
C -7.346256 -0.040641 -0.035866
C 2.940194 -0.784200 -0.464499
C 3.082069 1.303091 0.818169
C 1.540415 -0.712242 -0.426604
C 1.681182 1.366303 0.850467
C -5.052505 0.893972 0.528870
C -5.188810 -1.190975 -0.718889
C -0.588269 0.491999 0.305929
C -3.650548 0.831273 0.493600
C -3.784807 -1.254957 -0.755059
C -1.515098 -0.372415 -0.223022
C 8.247008 -1.489782 -0.866076
C 8.636010 0.959399 0.652648
C -8.020616 0.558414 1.065244
C -8.136016 -0.567535 -1.096663
C 9.541026 -1.005381 -0.554065
C 9.730131 0.194513 0.190067
C -9.429011 0.628720 1.104953
C -9.544520 -0.498925 -1.057666
C -10.199920 0.100070 0.043473
H 3.438571 -1.615452 -0.972471
H 3.695192 2.074256 1.294865
H 0.958195 -1.501107 -0.914220
H 1.191263 2.203774 1.361985
H -5.535660 1.754729 1.004860
H -5.773982 -2.001780 -1.166465
H -0.945308 1.379734 0.846906
H -3.073685 1.635617 0.962868
H -3.296530 -2.104150 -1.249469
H -1.156975 -1.261116 -0.762218
H 8.094294 -2.409647 -1.436441
H 8.776159 1.881100 1.224096
H -7.439384 0.942553 1.911076
H -7.643505 -1.004374 -1.972833
H 10.416705 -1.568379 -0.894112
H 10.750020 0.529362 0.407040
H -9.925343 1.086667 1.967928
H -10.130663 -0.903347 -1.890557
H -11.293701 0.154078 0.073647


