%chk=000002541.chk
%nprocshared=4
%mem=4GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002541

0 1
 O    2.973100      -2.892100     -0.2881000    
 O   0.8797000       2.334300       1.527800    
 O    2.638300       2.128600       2.953000    
 N    2.729200     -0.6696000      0.4891000    
 N    3.928800      -1.038700      -1.345200    
 N   -3.202400       2.408100     -0.2801000    
 N   -2.792700       1.208300      -2.156400    
 N   -2.416800       3.033800      -1.167900    
 N   -2.147300       2.360000      -2.294600    
 C    1.909100     -0.9648000       1.642600    
 C    3.163800      0.5655000      8.1400000E-02
 C   0.4445000     -0.9295000       1.298500    
 C    3.910300      0.3083000      -1.065300    
 C    3.211600      -1.594600     -0.3945000    
 C    2.973700       1.846400      0.6010000    
 C  -1.0000000E-03  -1.549600      0.1392000    
 C  -0.4415000     -0.2771000       2.145000    
 C   -2.257500     -0.8641000      0.6636000    
 C    4.510200       1.380800      -1.746600    
 C   -1.358500      -1.516800     -0.1799000    
 C   -1.799000     -0.2443000       1.826100    
 C    3.577700       2.902000     -9.0000004E-02
 C   -3.665700     -0.8308000      0.3331000    
 C    4.332800       2.675400      -1.243000    
 C   -4.216800      0.1947000     -0.4394000    
 C    2.195600       2.106300       1.797800    
 C    3.520100      -3.787700      -1.262000    
 C   -4.485700      -1.858400      0.8054000    
 C   -5.579500      0.1923000     -0.7374000    
 C   -5.848400      -1.860700      0.5073000    
 C   -3.408500       1.273500     -0.9462000    
 C   -6.395300     -0.8354000     -0.2641000    
 C    3.117900      -5.204100     -0.9101000    
 H    2.179200     -0.3009000       2.464400    
 H    2.163700      -1.974600       1.988700    
 H   0.6482000      -2.085200     -0.5396000    
 H  -9.8999999E-02  0.1965000       3.060600    
 H    5.098700       1.215300      -2.643400    
 H   -1.700400      -2.007900      -1.088000    
 H   -2.486600      0.2665000       2.496100    
 H    3.463600       3.922700      0.2697000    
 H    4.790300       3.516100      -1.758300    
 H    3.134900      -3.528100      -2.254800    
 H    4.612900      -3.703000      -1.266100    
 H   -4.078600      -2.667200       1.408300    
 H   -6.023300      0.9833000      -1.337800    
 H   -6.483600      -2.660800      0.8757000    
 H   -7.456300     -0.8374000     -0.4962000    
 H    3.519200      -5.916600      -1.636200    
 H    3.482600      -5.471700      8.6999997E-02
 H    2.027300      -5.299800     -0.8859000    
 H   0.3695000       2.530100       2.342500    
 H   -2.046700       3.962600     -0.9965000    


%chk=000002541-Freq.chk
%nprocshared=4
%mem=4GB
#p freq=noraman PBEPBE/SDD

000002541

0 1
O 3.566430 -3.078648 -0.022493
O 0.817147 3.178277 1.291699
O 1.734452 1.431797 2.503220
N 2.734080 -0.900768 0.435828
N 4.047847 -1.181894 -1.446285
N -2.063090 1.821328 0.285930
N -3.386981 2.686181 -1.381797
N -1.542010 2.953140 -0.267078
N -2.311029 3.508650 -1.278236
C 1.874402 -1.377764 1.539450
C 2.825484 0.371412 -0.168036
C 0.382400 -1.300761 1.215020
C 3.634761 0.164925 -1.347242
C 3.487402 -1.763966 -0.381269
C 2.301426 1.663833 0.127407
C -0.096881 -1.341306 -0.116350
C -0.553058 -1.180263 2.270549
C -2.402419 -1.003713 0.665823
C 3.901289 1.216829 -2.243177
C -1.471515 -1.190823 -0.386851
C -1.931302 -1.046954 2.000773
C 2.566210 2.702605 -0.814515
C -3.832407 -0.679042 0.352427
C 3.346569 2.487584 -1.971280
C -4.197375 0.576450 -0.232650
C 1.628376 2.004194 1.393156
C 4.375961 -3.941711 -0.942972
C -4.849217 -1.635533 0.593035
C -5.548172 0.816324 -0.601536
C -6.193787 -1.382487 0.241415
C -3.221940 1.662528 -0.434128
C -6.541217 -0.156457 -0.371499
C 4.334430 -5.350557 -0.365978
H 2.087380 -0.782067 2.441343
H 2.178647 -2.422970 1.726368
H 0.604350 -1.458014 -0.950369
H -0.198626 -1.146570 3.307929
H 4.517140 1.033680 -3.128615
H -1.825170 -1.179904 -1.424110
H -2.636942 -0.903522 2.826654
H 2.180444 3.702683 -0.599027
H 3.532674 3.321542 -2.655027
H 3.928612 -3.875776 -1.950922
H 5.397728 -3.524112 -0.987647
H -4.570531 -2.596146 1.040042
H -5.801220 1.778071 -1.059120
H -6.960943 -2.140740 0.433300
H -7.578947 0.043367 -0.659295
H 4.919761 -6.030226 -1.011544
H 4.768451 -5.376274 0.647996
H 3.298740 -5.727295 -0.314714
H 0.484540 3.384327 2.206933
H -0.626952 3.306434 0.057760


