%chk=000048250.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048250

0 1
 O  -0.2234000       1.561600      0.4656000    
 O    1.474000       2.241100     -0.9331000    
 N   -5.365100     -0.3112000     -0.5766000    
 C   -3.080100       1.209000      0.4542000    
 C   -4.424900       1.147900       1.186100    
 C   -3.293500      0.9586000      -1.042600    
 C   -5.171700     -0.1498000      0.8707000    
 C   -4.078100     -0.3326000      -1.284500    
 C   -2.385700       2.546900      0.6930000    
 C   -1.045900       2.614700     -1.7500000E-02
 C   -6.124800      -1.528900     -0.8590000    
 C    1.818100      0.3473000      0.5741000    
 C    1.033900       1.480800     -7.9899997E-02
 C    3.279400      0.3103000      0.1453000    
 C    1.151700      -1.016100      0.4462000    
 C    3.629600     -0.4350000     -0.9612000    
 C    1.355600      -1.952600       1.438500    
 C    4.206000       1.023500      0.8768000    
 C   0.3646000      -1.272100     -0.6573000    
 C    4.967500     -0.4689000      -1.354000    
 C   0.7453000      -3.201400       1.321600    
 C    5.544000      0.9897000      0.4838000    
 C  -0.2459000      -2.520900     -0.7740000    
 C    5.924700      0.2434000     -0.6317000    
 C  -5.5500001E-02  -3.485400      0.2156000    
 H   -2.451100      0.4008000      0.8520000    
 H   -5.048600       2.004700      0.8988000    
 H   -4.265300       1.220400       2.268600    
 H   -2.337700      0.8600000      -1.567500    
 H   -3.828300       1.803200      -1.496200    
 H   -4.621200      -1.002600       1.289600    
 H   -6.145900     -0.1130000       1.373300    
 H   -4.249900     -0.4302000      -2.363400    
 H   -3.474100      -1.194800     -0.9720000    
 H   -2.228200       2.673000       1.771500    
 H   -3.018200       3.377000      0.3567000    
 H   -1.146200       2.563700      -1.106200    
 H  -0.5705000       3.572500      0.2268000    
 H   -5.603500      -2.430800     -0.5182000    
 H   -7.105500      -1.492300     -0.3717000    
 H   -6.312800      -1.624500      -1.934100    
 H    1.804600      0.6006000       1.646600    
 H    2.912500     -0.9820000      -1.562000    
 H    1.978000      -1.740000       2.302500    
 H    3.919100       1.609400       1.744600    
 H   0.2111000     -0.5462000      -1.449400    
 H    5.263600      -1.045100      -2.225700    
 H   0.8937000      -3.952600       2.091800    
 H    6.289400       1.545200       1.045500    
 H  -0.8677000      -2.743000      -1.636300    
 H    6.966200      0.2184000     -0.9385000    
 H  -0.5305000      -4.457800      0.1243000    


%chk=000048250-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000048250

0 1
O 0.081774 2.051874 1.111747
O 0.297912 1.336099 -1.101754
N -4.961451 -0.244547 -0.922561
C -2.877365 1.286246 0.517489
C -4.171476 0.785539 1.206141
C -3.155364 1.480569 -0.993888
C -4.713096 -0.483218 0.519039
C -3.729383 0.195004 -1.619436
C -2.346515 2.567191 1.206073
C -0.970898 3.048120 0.723220
C -5.582953 -1.410243 -1.577605
C 1.589335 0.227315 0.712626
C 0.608527 1.239857 0.108627
C 2.941916 0.277139 -0.017885
C 0.972393 -1.185200 0.743956
C 3.089574 -0.208928 -1.340997
C 1.332027 -2.050524 1.808745
C 4.066705 0.831296 0.641599
C 0.086081 -1.662035 -0.254879
C 4.342070 -0.142003 -1.988648
C 0.823784 -3.365890 1.874665
C 5.322228 0.896070 -0.004875
C -0.428138 -2.977120 -0.185421
C 5.463174 0.408612 -1.323743
C -0.060292 -3.835270 0.875314
H -2.112773 0.486833 0.627032
H -4.945617 1.577414 1.156932
H -3.978137 0.568773 2.275578
H -2.226688 1.748531 -1.530488
H -3.886436 2.302935 -1.129527
H -3.979368 -1.321913 0.669765
H -5.665948 -0.792958 0.989117
H -3.975133 0.368802 -2.684173
H -2.940631 -0.606790 -1.587663
H -2.296781 2.404187 2.301120
H -3.064644 3.398071 1.039692
H -0.929528 3.190422 -0.370183
H -0.667880 3.975051 1.237511
H -4.933188 -2.323979 -1.563568
H -6.532996 -1.660918 -1.071791
H -5.808884 -1.169802 -2.632191
H 1.754260 0.544499 1.756696
H 2.226458 -0.634024 -1.862491
H 2.018431 -1.692967 2.586142
H 3.959973 1.215781 1.663784
H -0.207383 -1.005033 -1.081197
H 4.445073 -0.519675 -3.012246
H 1.113748 -4.021293 2.703710
H 6.184393 1.324994 0.518184
H -1.114022 -3.330923 -0.963568
H 6.434739 0.456657 -1.828357
H -0.458807 -4.854731 0.926132


