%chk=000052032.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052032

1 1
 O  -3.0700000E-02 -0.3817000      -1.299100    
 O   0.1259000     -0.3372000       1.092600    
 N    4.222100     -1.5600000E-02 -3.7200000E-02
 C    2.031300      -1.071700     -0.2196000    
 C    3.178100     -0.4084000     -0.9991000    
 C   0.8893000      -1.465300      -1.173700    
 C    1.504600     -7.8000002E-02  0.8313000    
 C    2.567800      -2.340500      0.4626000    
 C  -0.7145000     -8.6800002E-02 -5.8400001E-02
 C    4.766100      -1.237700      0.7236000    
 C    5.408500      0.6586000     -0.7488000    
 C    3.675000      0.9776000       1.003300    
 C   -1.968500     -0.9704000      1.1300000E-02
 C   -1.124900       1.392700     -2.9899999E-02
 C   -2.606600      -1.367000      -1.163300    
 C   -1.241700       2.061000       1.189100    
 C   -2.467000      -1.375200       1.248800    
 C   -1.380700       2.069200      -1.223000    
 C   -3.745500      -2.169700      -1.100100    
 C   -1.614400       3.405000       1.215100    
 C   -3.606000      -2.178000       1.311800    
 C   -1.753200       3.413100      -1.196900    
 C   -4.245100      -2.575200      0.1373000    
 C   -1.870000       4.081000      2.2200000E-02
 H    2.838100      0.4908000      -1.528400    
 H    3.620800      -1.091900      -1.734600    
 H    1.273300      -1.696800      -2.173300    
 H   0.3351000      -2.351200     -0.8430000    
 H    1.890600     -0.2602000       1.829100    
 H    1.480500      0.9582000      0.5062000    
 H    1.713100      -3.032100      0.5572000    
 H    3.236500      -2.947300     -0.1534000    
 H    2.805100      -2.278700       1.523800    
 H    5.792200     -0.9618000       1.011600    
 H    4.926800      -2.083300      5.3700000E-02
 H    4.317700      -1.364100       1.705900    
 H    6.169000      0.9349000     -1.2100000E-02
 H    5.816900     -5.5399999E-02  -1.470200    
 H    5.031100       1.547700      -1.262800    
 H    4.565400       1.546200       1.320100    
 H    3.430300      0.5429000       1.969500    
 H    3.095000       1.774600      0.5333000    
 H   -2.247300      -1.057100      -2.140500    
 H   -1.060000       1.557900       2.134500    
 H   -1.993300      -1.073200       2.178500    
 H   -1.305200       1.570800      -2.185200    
 H   -4.245100      -2.476900      -2.014300    
 H   -1.708100       3.924500       2.164200    
 H   -3.996600      -2.492200       2.275300    
 H   -1.954400       3.939200      -2.125500    
 H   -5.132600      -3.199200      0.1865000    
 H   -2.161200       5.127200      4.2399999E-02


%chk=000052032-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000052032

1 1
O 0.072695 -0.510842 -1.085003
O -0.147972 -0.492264 1.310234
N 4.395668 0.079134 -0.096827
C 2.011520 -1.187157 0.288161
C 3.048016 -0.503510 -0.646875
C 0.892453 -1.667479 -0.716785
C 1.274349 -0.158275 1.230136
C 2.518480 -2.412367 1.082717
C -0.845642 -0.159853 0.042128
C 5.435340 -1.032255 0.057228
C 4.912791 1.075303 -1.139900
C 4.240109 0.809145 1.232502
C -2.109012 -1.019522 -0.002791
C -1.105289 1.345620 -0.059450
C -2.765958 -1.202825 -1.245141
C -1.563807 2.039687 1.088191
C -2.653668 -1.593046 1.171475
C -0.948614 2.041074 -1.283135
C -3.954956 -1.959353 -1.312383
C -1.854277 3.419020 1.013974
C -3.845841 -2.348705 1.100042
C -1.244890 3.421402 -1.355065
C -4.499688 -2.533144 -0.139277
C -1.697507 4.113851 -0.208526
H 2.536628 0.340331 -1.146229
H 3.377560 -1.217153 -1.423949
H 1.310314 -2.060177 -1.659306
H 0.279142 -2.452094 -0.237418
H 1.636211 -0.221772 2.269243
H 1.385265 0.882189 0.861042
H 1.665009 -2.869898 1.613897
H 2.954588 -3.188264 0.425731
H 3.262598 -2.151071 1.858825
H 6.366091 -0.596811 0.452928
H 5.626036 -1.481388 -0.929317
H 5.055888 -1.796728 0.746320
H 5.923586 1.405434 -0.853741
H 4.945232 0.581089 -2.122809
H 4.232749 1.939396 -1.181066
H 5.207939 1.262727 1.498273
H 3.942102 0.092695 2.009696
H 3.478193 1.594718 1.131034
H -2.344706 -0.758579 -2.153162
H -1.693696 1.497574 2.030918
H -2.145018 -1.452662 2.129313
H -0.603590 1.501820 -2.170235
H -4.458390 -2.098160 -2.275100
H -2.212672 3.948507 1.903256
H -4.264079 -2.790663 2.010789
H -1.132996 3.953187 -2.306327
H -5.425521 -3.115974 -0.191551
H -1.935163 5.181391 -0.268283


