%chk=000101701.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101701

0 1
 O   -5.982500     -0.1772000     -0.7717000    
 N    5.208300     -0.3274000      -1.824000    
 C  -1.4100000E-02  0.9644000      0.3062000    
 C   -1.430400      0.9663000     -0.2792000    
 C   0.7017000     -0.3563000     -0.1287000    
 C   -2.281300     -0.2296000      0.2012000    
 C    2.187600     -0.4158000      0.3876000    
 C    2.915500      0.8608000     -0.1446000    
 C   -3.612300      0.1127000     -0.5121000    
 C  -0.1452000      -1.612900      0.2042000    
 C   -1.601400      -1.516700     -0.2871000    
 C   0.7798000       2.202100     -0.1363000    
 C   -2.333400       2.171300     -3.3900000E-02
 C    2.237000       2.155100      0.3191000    
 C   -3.751800       1.640300     -0.3127000    
 C    2.922300      -1.657500     -0.1939000    
 C    4.420200      0.8696000      0.1767000    
 C   -2.473300     -0.2938000       1.737400    
 C    2.226800     -0.5065000       1.935300    
 C    4.431800      -1.662200      8.3300002E-02
 C   -4.845200     -0.6579000     -6.2199999E-02
 C    5.137900     -0.3769000     -0.3606000    
 C   -4.698100      -2.152000     -0.3040000    
 H  -8.4700003E-02   1.003700       1.397800    
 H   -1.316200      0.8928000      -1.374000    
 H   0.7580000     -0.3296000      -1.228900    
 H    2.831200      0.8518000      -1.242100    
 H   -3.491900     -4.5899998E-02  -1.595100    
 H  -0.1438000      -1.800000       1.282400    
 H   0.3034000      -2.497100     -0.2624000    
 H   -1.604700      -1.553200      -1.384100    
 H   -2.113800      -2.416200      5.7500001E-02
 H   0.3145000       3.110700      0.2632000    
 H   0.7504000       2.289000      -1.230200    
 H   -2.086700       3.009200     -0.6937000    
 H   -2.255300       2.528400      0.9990000    
 H    2.762900       3.021500     -0.1006000    
 H    2.293600       2.257500       1.408700    
 H   -4.411300       1.889300      0.5266000    
 H   -4.174500       2.107100      -1.209400    
 H    2.760700      -1.704800      -1.278600    
 H    2.500900      -2.581100      0.2205000    
 H    4.882500       1.771100     -0.2475000    
 H    4.577700      0.9410000       1.259400    
 H   -3.016900      0.5725000       2.127500    
 H   -3.036100      -1.186900       2.028700    
 H   -1.525100     -0.3393000       2.279500    
 H    1.668800      0.2976000       2.420800    
 H    1.804600      -1.453500       2.287500    
 H    3.245000     -0.4580000       2.330800    
 H    4.605800      -1.811400       1.155700    
 H    4.883600      -2.532700     -0.4098000    
 H   -5.053900     -0.4809000      0.9984000    
 H    6.165500     -0.3860000      2.1700000E-02
 H   -4.102200      -2.636700      0.4710000    
 H   -5.681100      -2.637700     -0.2893000    
 H   -4.269200      -2.363900      -1.289000    
 H    5.734900      -1.128800      -2.169200    
 H    5.723800      0.5025000      -2.114300    
 H   -6.763300     -0.6478000     -0.4333000    


%chk=000101701-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101701

0 1
O -5.975892 -0.063671 -0.959806
N 5.199634 -0.302819 -1.869820
C 0.009999 0.960659 0.344353
C -1.420136 0.945534 -0.236725
C 0.744787 -0.351897 -0.087936
C -2.288288 -0.278912 0.215631
C 2.236950 -0.407538 0.423417
C 2.961981 0.876478 -0.123071
C -3.632297 0.070402 -0.517887
C -0.092776 -1.613320 0.263541
C -1.552042 -1.556451 -0.265796
C 0.795343 2.213907 -0.115543
C -2.341643 2.167006 -0.006438
C 2.272029 2.179540 0.335428
C -3.771673 1.625711 -0.338147
C 2.965901 -1.640160 -0.200300
C 4.477847 0.880280 0.180749
C -2.504386 -0.319912 1.753587
C 2.292786 -0.499856 1.974019
C 4.487861 -1.660100 0.075434
C -4.918748 -0.662255 -0.098319
C 5.202256 -0.365857 -0.386629
C -4.907653 -2.190388 -0.282595
H -0.057723 0.992398 1.452840
H -1.305189 0.837043 -1.341413
H 0.810065 -0.311553 -1.201717
H 2.869009 0.823140 -1.229756
H -3.486474 -0.146253 -1.597852
H -0.111811 -1.759103 1.361156
H 0.395989 -2.511277 -0.159578
H -1.537064 -1.562600 -1.376528
H -2.081829 -2.475433 0.051317
H 0.298353 3.126859 0.266450
H 0.757785 2.270217 -1.225069
H -2.064194 3.026492 -0.642264
H -2.276526 2.509878 1.044850
H 2.813868 3.051153 -0.085949
H 2.333013 2.279759 1.438889
H -4.488365 1.853459 0.472934
H -4.188225 2.080109 -1.251987
H 2.806878 -1.624446 -1.296812
H 2.524156 -2.580113 0.184701
H 4.932827 1.797893 -0.249783
H 4.659424 0.931898 1.272974
H -3.061445 0.563766 2.113173
H -3.079251 -1.219606 2.044168
H -1.549561 -0.354636 2.305009
H 1.709909 0.300410 2.462170
H 1.889182 -1.468162 2.322898
H 3.327708 -0.425179 2.350896
H 4.679557 -1.796852 1.157823
H 4.945632 -2.535099 -0.431539
H -5.150291 -0.420502 0.963268
H 6.240548 -0.380843 0.029727
H -4.191193 -2.677171 0.401813
H -5.908070 -2.616440 -0.068834
H -4.635820 -2.453410 -1.320447
H 5.602660 -1.134556 -2.315893
H 5.610668 0.560321 -2.243156
H -6.839039 -0.503842 -0.750423


