%chk=000126437.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126437

0 1
 O   2.4999999E-03 -0.5491000      1.7000000E-03
 N    7.307300      0.5925000     -5.1000002E-03
 N   -7.309100      0.5899000     -3.9999999E-04
 N    6.152600       2.624200      2.0000001E-03
 N   -6.156000       2.622400     -1.5000000E-03
 C    1.086700      -1.363700      2.6000000E-03
 C   -1.086800      -1.361200     -9.9999997E-05
 C    2.360600     -0.6874000      2.4999999E-03
 C   -2.355400     -0.6892000     -1.0000000E-03
 C   0.7111000      -2.682100      1.2000001E-03
 C  -0.7042000      -2.682500     -5.0000002E-04
 C    3.543100      -1.426900      3.9999999E-04
 C   -3.543300      -1.426500     -2.6000000E-03
 C    2.409800      0.7067000      2.9000000E-03
 C   -2.411700      0.7081000      8.9999998E-04
 C    4.824300      0.6215000     -5.0000002E-04
 C   -4.826200      0.6209000     -1.9999999E-04
 C    4.775000     -0.7726000     -8.9999998E-04
 C   -4.775700     -0.7731000     -2.4000001E-03
 C    3.641600       1.361100      1.5000000E-03
 C   -3.644000       1.361500      1.3000000E-03
 C    6.108600       1.303600     -2.7000001E-03
 C   -6.111000       1.301900      7.9999998E-04
 H    1.357800      -3.547900      1.0000000E-03
 H   -1.350600      -3.548800     -1.9000000E-03
 H    3.536800      -2.513800     -1.9999999E-04
 H   -3.536900      -2.513600     -4.0000002E-03
 H    1.510700       1.317800      4.1999999E-03
 H   -1.513100       1.320400      2.4000001E-03
 H    5.663000      -1.395000     -2.2000000E-03
 H   -5.663200      -1.396200     -3.7000000E-03
 H    3.644600       2.447800      1.7000000E-03
 H   -3.647800       2.448100      3.1999999E-03
 H    8.193700       1.086700     -4.9000001E-03
 H    7.364400     -0.4182000     -8.5000005E-03
 H   -8.195900       1.083400     -1.2000001E-03
 H   -7.365400     -0.4208000      8.9999998E-04
 H    7.137000       2.913700      1.3000000E-03
 H   -7.140600       2.911100     -2.0000001E-03


%chk=000126437-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126437

0 1
O -0.000075 -0.477539 -0.000541
N 7.492861 0.523012 -0.003560
N -7.493349 0.520217 0.002958
N 6.326943 2.636034 0.004313
N -6.328171 2.633653 -0.003074
C 1.142271 -1.310762 -0.000536
C -1.142225 -1.311483 -0.000979
C 2.447224 -0.663459 -0.000116
C -2.447392 -0.664519 -0.001050
C 0.717556 -2.642380 -0.000889
C -0.716691 -2.642742 -0.001255
C 3.638838 -1.441463 0.000119
C -3.638689 -1.442954 -0.002023
C 2.568597 0.757098 0.000181
C -2.569159 0.755968 -0.000231
C 5.023191 0.594163 0.000714
C -5.023727 0.592221 -0.001074
C 4.901544 -0.822270 0.000504
C -4.901610 -0.824172 -0.002003
C 3.831637 1.367978 0.000565
C -3.832415 1.366417 -0.000227
C 6.339975 1.314918 0.001118
C -6.340734 1.312523 -0.000974
H 1.360776 -3.519893 -0.000911
H -1.359474 -3.520591 -0.001611
H 3.576528 -2.535134 0.000110
H -3.576012 -2.536599 -0.002922
H 1.661328 1.368383 0.000096
H -1.662095 1.367544 0.000415
H 5.783751 -1.473470 0.001284
H -5.783614 -1.475655 -0.003379
H 3.942274 2.456247 0.000936
H -3.943406 2.454652 0.000261
H 8.409400 0.964508 -0.003870
H 7.458604 -0.492285 -0.008464
H -8.410039 0.961399 0.003571
H -7.458737 -0.495073 0.007021
H 7.276737 3.061470 0.003233
H -7.278125 3.058740 -0.001710


