%chk=000122458.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122458

0 1
 O   0.3005000       2.451500     -1.0000000E-03
 O  -0.5681000      -2.820700     -2.4999999E-03
 O    2.820500       2.106500      1.1000000E-03
 O   -2.205800       2.972500     -3.9999999E-04
 N   -3.159600      -2.511200      2.4000001E-03
 N    4.939900      0.3428000      1.5000000E-03
 C   -1.525300     -0.6526000     -9.9999997E-05
 C    1.221500      0.2895000     -3.9999999E-04
 C   -1.287400      0.7233000     -5.0000002E-04
 C   0.9835000      -1.086500     -6.0000003E-04
 C   9.4700001E-02   1.244700     -1.0000000E-03
 C  -0.3986000      -1.607900     -6.9999998E-04
 C   -2.840100      -1.133800      5.0000002E-04
 C    2.536100      0.7708000      1.9999999E-04
 C   -2.364200       1.618200     -3.0000001E-04
 C    2.060300      -1.981300     -3.0000001E-04
 C    3.606300     -0.1243000      5.0000002E-04
 C   -3.910300     -0.2386000      1.0000000E-03
 C    3.368900      -1.497400      9.9999997E-05
 C   -3.672800       1.134400      5.0000002E-04
 H    1.904200      -3.056700     -3.9999999E-04
 H   -4.937300     -0.5961000      1.9000000E-03
 H    4.195200      -2.204000      3.0000001E-04
 H   -4.520600       1.814800      1.0000000E-03
 H   -2.431700      -3.211400     -6.0000003E-04
 H   -4.128000      -2.803900      3.0000001E-04
 H    5.708300     -0.3145000      1.1000000E-03
 H    5.123500       1.337400      1.2000001E-03
 H    2.010700       2.637000      7.1000000E-03
 H   -3.077400       3.403700     -9.9999997E-05


%chk=000122458-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000122458

0 1
O 0.408361 2.516667 0.000581
O -0.619963 -2.932061 -0.000770
O 2.852953 2.100371 0.001156
O -2.170324 3.031185 0.000864
N -3.155980 -2.519701 -0.000146
N 4.931143 0.391929 0.001096
C -1.524408 -0.677609 -0.000114
C 1.215774 0.272042 0.000199
C -1.274163 0.750518 0.000175
C 0.970233 -1.138037 -0.000131
C 0.117518 1.245508 0.000014
C -0.406243 -1.649070 -0.000562
C -2.879626 -1.171089 0.000001
C 2.552935 0.756188 0.000629
C -2.378579 1.649649 0.000563
C 2.068436 -2.028090 -0.000100
C 3.664103 -0.156605 0.000658
C -3.957317 -0.227507 0.000363
C 3.393915 -1.550229 0.000270
C -3.709643 1.142348 0.000639
H 1.858200 -3.101393 -0.000390
H -4.989014 -0.597500 0.000469
H 4.231529 -2.257259 0.000290
H -4.553452 1.845159 0.000943
H -2.329811 -3.148297 0.000023
H -4.117948 -2.850737 0.000049
H 5.763940 -0.188898 0.001185
H 5.014548 1.407766 0.001352
H 1.913286 2.588453 0.001373
H -3.043503 3.502499 0.001119


