%chk=000145564.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145564

0 1
 O   -1.990400      -1.484000     -0.4464000    
 N   -2.331200     -0.3107000     -7.7799998E-02
 C   -3.768000     -2.2900000E-02  3.6899999E-02
 C   -4.508100      -1.298800     -0.3441000    
 C   -4.010400      0.3717000       1.487300    
 C   -4.060900       1.117800     -0.9290000    
 C    4.250400      7.2800003E-02 -0.1177000    
 C    2.768000      0.2199000     -4.6300001E-02
 C   -1.450500      0.6387000      0.1615000    
 C   9.8000001E-03  0.4946000      9.0400003E-02
 C    2.171900       1.439900     -0.3659000    
 C    1.977700     -0.8618000      0.3423000    
 C   0.7855000       1.577900     -0.2972000    
 C   0.5913000     -0.7239000      0.4109000    
 C    4.688500     -0.9771000      -1.156400    
 C    4.876500     -0.2541000       1.251300    
 H   -4.268300      -2.135800      0.3229000    
 H   -5.591300      -1.141700     -0.2739000    
 H   -4.301400      -1.609200      -1.375400    
 H   -3.526800       1.313500       1.766900    
 H   -3.650100     -0.3998000       2.178200    
 H   -5.083000      0.5026000       1.672000    
 H   -3.700900      0.8917000      -1.939700    
 H   -5.142100       1.286900     -0.9977000    
 H   -3.619700       2.072700     -0.6265000    
 H    4.686500       1.028600     -0.4388000    
 H   -1.822000       1.643300      0.4158000    
 H    2.772600       2.292800     -0.6704000    
 H    2.422100      -1.817500      0.6064000    
 H   0.3309000       2.531800     -0.5497000    
 H   2.0000000E-02  -1.574300      0.7674000    
 H    4.363700      -1.986200     -0.8808000    
 H    5.779700     -0.9920000      -1.250200    
 H    4.269300     -0.7473000      -2.142300    
 H    4.591400      0.4952000       1.998300    
 H    5.969700     -0.2602000       1.181500    
 H    4.560900      -1.234900       1.622700    


%chk=000145564-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000145564

0 1
O -2.100602 -1.714207 0.092234
N -2.372338 -0.410894 0.064970
C -3.884856 -0.003094 0.075092
C -4.716266 -1.299202 0.068745
C -4.161672 0.806621 1.365719
C -4.180287 0.829511 -1.196498
C 4.411001 0.128941 -0.008351
C 2.883073 0.210182 0.004111
C -1.435102 0.553160 0.034429
C 0.006256 0.371510 0.026001
C 2.220807 1.465888 -0.022599
C 2.077686 -0.959253 0.042121
C 0.817042 1.548725 -0.012235
C 0.671446 -0.896152 0.053198
C 4.933341 -0.602540 -1.274486
C 4.958179 -0.541811 1.280518
H -4.488393 -1.922861 0.947398
H -5.788280 -1.031320 0.082154
H -4.506613 -1.903199 -0.828420
H -3.607347 1.761147 1.389511
H -3.882214 0.220498 2.258696
H -5.240012 1.040297 1.428261
H -3.894674 0.268640 -2.103622
H -5.262996 1.044319 -1.249109
H -3.645926 1.795535 -1.202468
H 4.800296 1.167081 -0.036959
H -1.818431 1.576684 0.011997
H 2.817246 2.386402 -0.052013
H 2.558545 -1.945124 0.062975
H 0.332490 2.533666 -0.033959
H 0.062343 -1.801541 0.082872
H 4.586461 -1.652211 -1.297522
H 6.039239 -0.611303 -1.289692
H 4.576396 -0.109330 -2.196400
H 4.623378 -0.002070 2.184518
H 6.064092 -0.555121 1.272167
H 4.607992 -1.587372 1.363146


