%chk=000025687.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025687

0 1
 I   6.8800002E-02   2.123900      -1.165700    
 I    3.854800      -2.417600      0.4518000    
 I   -2.024400      -3.407200      0.2612000    
 O   -1.932400     -0.3044000     -0.6280000    
 O   -2.878500       2.449800       1.312000    
 O   -3.187200       2.164000     -0.9235000    
 O    4.328800       2.060700      0.4891000    
 N    2.812000      0.5362000     -0.4810000    
 C   -2.630900      0.2498000      0.4757000    
 C   -3.887200     -0.5793000      0.7482000    
 C  -0.6535000     -0.7430000     -0.3963000    
 C    1.720900     -0.3295000     -0.3218000    
 C   0.4233000      0.1244000     -0.5583000    
 C   -4.840700     -0.6587000     -0.4391000    
 C    1.936600      -1.649100      7.5599998E-02
 C  -0.4428000      -2.060700      3.0000001E-04
 C   0.8548000      -2.514600      0.2367000    
 C   -2.940700       1.701900      0.1815000    
 C    3.526000      0.5373000      -1.791900    
 C    3.324800       1.349900      0.5827000    
 C    2.567500       1.366100       1.890800    
 H   -1.999600      0.2253000       1.376000    
 H   -4.440300     -6.8899997E-02   1.550200    
 H   -3.696900      -1.558700       1.164300    
 H   -5.720400      -1.252500     -0.1699000    
 H   -4.366900      -1.135500      -1.302300    
 H   -5.194500      0.3314000     -0.7409000    
 H    1.021800      -3.544100      0.5469000    
 H    3.530300       1.561500      -2.176500    
 H    3.034500     -0.1300000      -2.505200    
 H    4.561800      0.2272000      -1.626800    
 H    2.440300      0.3530000       2.278600    
 H    1.592700       1.839900       1.762400    
 H    3.133200       1.939600       2.631600    
 H   -3.062800       3.396900       1.134700    


%chk=000025687-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000025687

0 1
I 0.244963 2.199945 -1.014141
I 3.917025 -2.567220 0.263589
I -2.050714 -3.520115 -0.521777
O -1.954276 -0.289822 -0.786873
O -3.676937 2.697813 0.422157
O -3.585864 1.791099 -1.721562
O 4.375411 1.982860 0.760077
N 2.923372 0.526596 -0.300012
C -2.606979 0.578433 0.233805
C -3.616299 -0.239208 1.080636
C -0.656760 -0.737756 -0.522846
C 1.798435 -0.358202 -0.286070
C 0.477505 0.126905 -0.519472
C -4.846519 -0.732540 0.293566
C 1.965193 -1.758487 -0.099210
C -0.428085 -2.134178 -0.372110
C 0.869898 -2.643232 -0.162987
C -3.310740 1.713255 -0.513350
C 3.661260 0.740381 -1.570588
C 3.376805 1.210609 0.842751
C 2.613493 0.974345 2.140678
H -1.839972 1.019065 0.897723
H -3.932529 0.405593 1.922983
H -3.064926 -1.096230 1.511195
H -5.459503 -1.400798 0.923938
H -4.542226 -1.290044 -0.607911
H -5.487389 0.109074 -0.026597
H 1.021917 -3.717572 -0.045626
H 3.722203 1.819983 -1.788733
H 3.129116 0.226093 -2.386300
H 4.689282 0.346425 -1.489573
H 2.528405 -0.100883 2.377636
H 1.592207 1.393476 2.080905
H 3.156930 1.482898 2.950260
H -4.170500 3.426439 -0.043060


