%chk=000078488.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078488

0 1
 O   1.9000000E-03  0.2285000     -8.9999998E-04
 N   -2.691500     -0.8104000     -5.0000002E-04
 N    2.690100     -0.8099000     -7.9999998E-04
 N   -3.502700       1.258900      9.9999997E-05
 N    3.502100       1.259100      6.0000003E-04
 C   -2.410700      0.5275000     -6.0000003E-04
 C    2.414600      0.5264000     -9.9999997E-05
 C   -1.092300       1.038900     -7.9999998E-04
 C    1.091700       1.040200     -3.9999999E-04
 C   -4.055500     -0.9520000     -9.9999997E-05
 C    4.054000     -0.9521000     -3.9999999E-04
 C   -4.538800      0.3536000      3.0000001E-04
 C    4.537900      0.3533000      5.0000002E-04
 C  -0.7054000       2.362000     -3.9999999E-04
 C   0.7100000       2.361600     -9.9999997E-05
 C   -4.882700      -2.075600     -9.9999997E-05
 C    4.880900      -2.076000     -5.0000002E-04
 C   -5.927200      0.5698000      8.9999998E-04
 C    5.926400      0.5690000      1.1000000E-03
 C   -6.261800      -1.842000      3.0000001E-04
 C    6.260100      -1.842800      1.9999999E-04
 C   -6.776800     -0.5435000      8.9999998E-04
 C    6.775600     -0.5447000      8.9999998E-04
 H   -2.017100      -1.564500     -7.9999998E-04
 H    2.015000      -1.563400     -1.5000000E-03
 H   -1.355200       3.226300     -1.9999999E-04
 H    1.360400       3.225300      3.0000001E-04
 H   -4.480500      -3.082300     -3.9999999E-04
 H    4.478300      -3.082500     -1.0000000E-03
 H   -6.337300       1.574700      1.3000000E-03
 H    6.336800       1.573600      1.7000000E-03
 H   -6.945200      -2.687600      1.9999999E-04
 H    6.943100      -2.688700      9.9999997E-05
 H   -7.853400     -0.3937000      1.3000000E-03
 H    7.852300     -0.3953000      1.3000000E-03


%chk=000078488-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000078488

0 1
O -0.000131 0.463302 0.000177
N -2.592778 -0.710355 0.000042
N 2.592476 -0.711217 0.000017
N -3.614223 1.343665 0.000078
N 3.614272 1.342681 0.000270
C -2.431299 0.686571 0.000132
C 2.431142 0.685812 0.000164
C -1.135334 1.316436 0.000200
C 1.135355 1.315869 0.000217
C -3.968981 -0.972724 0.000028
C 3.968623 -0.973774 -0.000009
C -4.590921 0.328387 0.000050
C 4.590770 0.327227 0.000147
C -0.716996 2.645193 0.000294
C 0.717630 2.644891 0.000291
C -4.716319 -2.167804 -0.000005
C 4.715767 -2.168973 -0.000152
C -6.001829 0.434885 0.000030
C 6.001693 0.433508 0.000169
C -6.122016 -2.036356 -0.000024
C 6.121492 -2.037752 -0.000128
C -6.753915 -0.756694 -0.000008
C 6.753595 -0.758194 0.000031
H -1.832777 -1.387600 0.000037
H 1.832402 -1.388382 -0.000083
H -1.384480 3.503389 0.000340
H 1.385526 3.502762 0.000340
H -4.242018 -3.154705 -0.000026
H 4.241319 -3.155802 -0.000278
H -6.479083 1.419190 0.000040
H 6.479121 1.417728 0.000292
H -6.744004 -2.938190 -0.000055
H 6.743333 -2.939688 -0.000233
H -7.848005 -0.704959 -0.000030
H 7.847691 -0.706625 0.000047


