%chk=000159072.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159072

1 1
 O    1.133900      -3.376300     -0.4201000    
 O    3.804900      -3.322100      0.3416000    
 O   -4.653500      0.9849000     -0.5464000    
 O   -4.623300      -1.626600      0.4038000    
 N    1.756800       2.793500     -0.4161000    
 C   0.8733000       1.518300     -0.2247000    
 C    2.892200       2.795600      0.6111000    
 C    1.680600      0.2385000     -9.1300003E-02
 C    3.775100       1.559400      0.4819000    
 C  -6.7299999E-02   1.651800      0.9853000    
 C    3.030900      0.2642000      0.2953000    
 C    2.315200       2.819600      -1.850000    
 C   0.9495000       4.086500     -0.2507000    
 C    1.058500     -0.9985000     -0.3305000    
 C   -1.279700      0.7826000      0.8290000    
 C    3.732400     -0.9443000      0.4319000    
 C    1.764100      -2.192200     -0.1845000    
 C    3.100800      -2.165200      0.1990000    
 C   -2.415200       1.290300      0.2071000    
 C   -1.258000     -0.5228000       1.307500    
 C   -3.543000      0.4824000      6.1900001E-02
 C   -2.385800      -1.330600       1.162400    
 C   -3.528400     -0.8279000      0.5397000    
 C    1.182700      -3.883000      -1.752500    
 C   -4.586600       2.333300      -1.006400    
 C   -4.710000      -2.411400     -0.7841000    
 H   0.2833000       1.464900      -1.150300    
 H    2.426000       2.832000       1.602900    
 H    3.476100       3.712500      0.4697000    
 H    4.400700       1.492900       1.380800    
 H    4.457600       1.686200     -0.3678000    
 H  -0.4453000       2.664500       1.139400    
 H   0.4510000       1.401800       1.921300    
 H    3.017700       3.654300      -1.931000    
 H    2.820000       1.875700      -2.066100    
 H    1.476200       2.957000      -2.539200    
 H    1.549600       4.916500     -0.6380000    
 H   2.2399999E-02   3.992800     -0.8235000    
 H   0.7581000       4.266800      0.8101000    
 H   5.4400001E-02  -1.042900     -0.7418000    
 H    4.782900     -0.9228000      0.7147000    
 H   -2.366300       2.314200     -0.1474000    
 H  -0.4041000     -0.9130000       1.854300    
 H   -2.372300      -2.345800       1.549700    
 H    4.715000      -3.108900      0.6104000    
 H   0.6962000      -3.188300      -2.444500    
 H   0.6451000      -4.834800      -1.776900    
 H    2.218200      -4.057700      -2.061300    
 H   -3.829500       2.456000      -1.788400    
 H   -4.449300       3.036400     -0.1779000    
 H   -5.554400       2.566000      -1.462900    
 H   -4.731900      -1.768700      -1.669800    
 H   -5.638400      -2.987800     -0.7470000    
 H   -3.867600      -3.107800     -0.8457000    


%chk=000159072-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159072

1 1
O 0.888970 -2.984571 -1.389913
O 3.567327 -3.350385 -0.229198
O -4.594793 0.514298 -0.719937
O -4.397397 -1.959105 0.746917
N 1.879794 2.956292 -0.313021
C 0.874061 1.741036 -0.227879
C 2.911688 2.826164 0.825756
C 1.668115 0.441664 -0.290219
C 3.768276 1.559826 0.690565
C -0.055356 1.829162 1.027876
C 2.980867 0.334550 0.240428
C 2.568373 2.939072 -1.676999
C 1.166380 4.296897 -0.177087
C 1.043194 -0.698579 -0.840290
C -1.215309 0.843346 0.930297
C 3.608145 -0.932006 0.236491
C 1.663262 -1.968935 -0.848778
C 2.968680 -2.083586 -0.270702
C -2.338885 1.143468 0.116367
C -1.195886 -0.373519 1.646537
C -3.428540 0.247325 0.010985
C -2.267407 -1.281370 1.531496
C -3.386041 -1.003641 0.714007
C 1.471475 -4.273196 -1.834626
C -4.715372 1.814849 -1.382987
C -5.247680 -2.222027 -0.435600
H 0.245174 1.850015 -1.132550
H 2.328310 2.820504 1.760103
H 3.531557 3.739356 0.806427
H 4.244793 1.381947 1.673357
H 4.601896 1.745103 -0.015894
H -0.466905 2.850841 1.123148
H 0.531166 1.608719 1.937214
H 3.378104 3.685655 -1.679449
H 2.968963 1.936372 -1.873629
H 1.823303 3.193993 -2.446590
H 1.861713 5.094491 -0.482543
H 0.282193 4.305443 -0.833182
H 0.861679 4.462112 0.865047
H 0.035737 -0.642286 -1.263213
H 4.624354 -1.028256 0.643523
H -2.386420 2.107358 -0.404713
H -0.341739 -0.624846 2.284505
H -2.267818 -2.231809 2.072688
H 4.454666 -3.320403 0.207497
H 2.315636 -4.104666 -2.524700
H 0.641566 -4.770305 -2.357668
H 1.807259 -4.871797 -0.975059
H -3.939091 1.944222 -2.162730
H -4.660079 2.643279 -0.650560
H -5.709091 1.804613 -1.852965
H -5.962213 -1.402304 -0.600836
H -5.772685 -3.155915 -0.185389
H -4.626473 -2.366463 -1.338327


