%chk=000174640.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174640

0 1
 O   -6.174300      0.4985000      4.3200001E-02
 O   -5.017800      -1.470500     -2.7899999E-02
 N   0.6762000       1.916500      2.0199999E-02
 N    1.394600     -0.8133000      1.5500000E-02
 N   -2.280900      -1.056600     -4.0100001E-02
 N  -0.5997000      -2.725300     -7.0900001E-02
 N   -3.949400      0.6154000      2.5400000E-02
 C    2.023300       1.557900     -0.3859000    
 C    3.023300       2.446100      0.3450000    
 C    4.440500       2.139600     -0.1240000    
 C    2.322400      8.8399999E-02 -0.1047000    
 C    4.760500      0.6718000     -2.5300000E-02
 C    3.757100     -0.3113000     -2.4800001E-02
 C  -0.3080000      0.9422000     -1.0800000E-02
 C   5.4099999E-02 -0.4071000     -3.3399999E-02
 C    6.104100      0.2715000      2.6799999E-02
 C    4.100800      -1.667500      5.5900000E-02
 C   -1.661700       1.278300      2.4300000E-02
 C  -0.9628000      -1.354400     -4.9800001E-02
 C    6.442300      -1.079300      0.1035000    
 C    5.441600      -2.046800      0.1208000    
 C   -2.596700      0.2551000      1.6000000E-03
 C   -5.024700     -0.2464000      9.4999997E-03
 C   -7.402800     -0.2381000      3.2699998E-02
 C   -8.561700      0.7350000      7.3399998E-02
 H    2.107600       1.703800      -1.470900    
 H    2.948600       2.284600       1.429300    
 H    2.801000       3.505500      0.1679000    
 H    5.144100       2.719100      0.4856000    
 H    4.565700       2.454700      -1.167200    
 H   0.3963000       2.890100     -1.2000000E-02
 H    6.897900       1.014700      1.0600000E-02
 H    3.343200      -2.446400      6.3100003E-02
 H   -1.967500       2.320400      5.9999999E-02
 H    7.486100      -1.375900      0.1483000    
 H    5.705000      -3.098900      0.1804000    
 H   0.2896000      -2.991900      0.3332000    
 H   -1.352900      -3.401800     -7.1099997E-02
 H   -4.160700       1.609500      5.7500001E-02
 H   -7.458300     -0.8417000     -0.8801000    
 H   -7.441100     -0.8961000      0.9080000    
 H   -9.518200      0.2049000      6.6600002E-02
 H   -8.509600       1.358900      0.9718000    
 H   -8.526500       1.412400     -0.7862000    


%chk=000174640-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000174640

0 1
O -6.244722 0.490303 0.093874
O -5.192133 -1.606034 -0.149706
N 0.682872 1.871200 0.011252
N 1.429841 -0.831365 -0.065744
N -2.275698 -1.157535 -0.155043
N -0.589049 -2.773530 -0.282954
N -4.001032 0.470091 0.018061
C 2.059715 1.566661 -0.431718
C 3.073494 2.513389 0.243407
C 4.499035 2.174002 -0.233893
C 2.380251 0.089473 -0.123459
C 4.833401 0.701997 -0.019454
C 3.799779 -0.285954 0.036443
C -0.325270 0.921444 -0.062019
C 0.085403 -0.447417 -0.154239
C 6.181903 0.297039 0.122144
C 4.157280 -1.651758 0.233754
C -1.704005 1.230743 0.004355
C -0.939122 -1.448911 -0.198315
C 6.525501 -1.058682 0.308169
C 5.501784 -2.038251 0.364394
C -2.624940 0.146854 -0.047803
C -5.114926 -0.368540 -0.028458
C -7.559600 -0.202659 0.068245
C -8.627551 0.873803 0.241466
H 2.151874 1.706149 -1.538728
H 2.996885 2.396695 1.341013
H 2.828953 3.565719 -0.004952
H 5.237197 2.806766 0.292335
H 4.591029 2.422200 -1.312446
H 0.434393 2.853479 0.133151
H 6.971636 1.058091 0.088354
H 3.349329 -2.387878 0.278842
H -2.049259 2.267543 0.083601
H 7.576271 -1.350114 0.415146
H 5.757747 -3.093132 0.513092
H 0.399318 -3.017532 -0.272471
H -1.324660 -3.475638 -0.277212
H -4.234690 1.459760 0.118602
H -7.657650 -0.740046 -0.892955
H -7.581169 -0.951026 0.881507
H -9.631103 0.410654 0.228927
H -8.501053 1.403080 1.201572
H -8.576662 1.614465 -0.575136


