%chk=000169140.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169140

0 1
 O   -5.022700      -2.023100     -1.6000000E-03
 O   -3.068600      -3.023500       0.000000    
 O    5.465000     -0.2054000      5.0000002E-04
 N    3.353100      -1.252100       0.000000    
 N   -3.771400      -1.987600     -1.9999999E-04
 C   0.2658000      0.8377000      1.9999999E-04
 C   -1.144100      0.6955000      1.9999999E-04
 C    1.091800     -0.3104000      6.0000003E-04
 C   -1.724600     -0.5942000      3.9999999E-04
 C   0.8464000       2.127400     -9.9999997E-05
 C   -1.970100       1.843700     -9.9999997E-05
 C    2.485500     -0.1530000      5.0000002E-04
 C   0.4989000      -1.580100      1.3000000E-03
 C  -0.8903000      -1.720100      7.9999998E-04
 C   -3.121600     -0.7181000      6.9999998E-04
 C   1.2000000E-02   3.253300     -1.9999999E-04
 C   -1.377200       3.113400     -3.9999999E-04
 C    2.243500       2.251100     -3.9999999E-04
 C   -3.363700       1.686600     -3.0000001E-04
 C    3.056000       1.118600       0.000000    
 C   -3.933900      0.4147000      9.9999997E-05
 C    4.738600      -1.193600     -8.9999998E-04
 C    5.331400      -2.580900     -1.1000000E-03
 H    1.076600      -2.499400      2.0999999E-03
 H   -1.145200      -2.764900      1.6000000E-03
 H   0.4359000       4.255500     -3.9999999E-04
 H   -1.992400       4.010900     -6.0000003E-04
 H    2.710100       3.234200     -6.9999998E-04
 H   -4.018400       2.555600     -6.9999998E-04
 H    4.109300       1.346500     -3.9999999E-04
 H   -5.019600      0.3566000     -9.9999997E-05
 H    2.944100      -2.179400     -1.9999999E-04
 H    5.016900      -3.119900      0.8972000    
 H    6.423100      -2.516600     -1.0700000E-02
 H    5.002200      -3.126700     -0.8901000    


%chk=000169140-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169140

0 1
O -5.201970 -1.978715 -0.000309
O -3.257232 -3.148872 0.000787
O 5.592728 -0.246472 -0.000897
N 3.439926 -1.206300 -0.000980
N -3.905137 -2.024130 -0.000109
C 0.281956 0.859263 -0.000134
C -1.150643 0.683344 -0.000026
C 1.161745 -0.282418 -0.000290
C -1.732534 -0.647391 -0.000018
C 0.838770 2.190932 -0.000104
C -2.000627 1.854397 0.000077
C 2.589567 -0.074881 -0.000538
C 0.550674 -1.585525 -0.000167
C -0.822517 -1.770179 -0.000036
C -3.168296 -0.741502 -0.000015
C -0.039031 3.332292 0.000030
C -1.413202 3.170374 0.000112
C 2.250774 2.346293 -0.000216
C -3.414044 1.689560 0.000132
C 3.117321 1.243936 -0.000442
C -3.986996 0.416153 0.000066
C 4.846072 -1.264533 -0.000986
C 5.390156 -2.692249 0.000163
H 1.162541 -2.495952 -0.000064
H -1.239496 -2.775723 0.000105
H 0.404971 4.334216 0.000055
H -2.080008 4.039407 0.000200
H 2.673367 3.357480 -0.000165
H -4.055889 2.576868 0.000220
H 4.199812 1.376841 -0.000614
H -5.070467 0.279114 0.000062
H 2.975583 -2.115787 -0.001228
H 5.066765 -3.245067 0.901736
H 6.488264 -2.647956 -0.010328
H 5.049495 -3.254516 -0.889081


