%chk=000096730.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096730

0 1
 O    4.137500     -0.9095000      1.3000000E-03
 O    2.410300      -2.264400     -9.9999997E-05
 N  -0.1774000      -1.210400     -1.0000000E-03
 N    2.900700      -1.111200      9.9999997E-05
 C  -0.2130000       1.019100     -3.9999999E-04
 C   0.6264000     -9.5100001E-02 -6.9999998E-04
 C   -1.560900      0.5384000     -9.9999997E-05
 C   -1.505900     -0.8557000     -3.9999999E-04
 C    2.022300      8.8000000E-03 -5.0000002E-04
 C   0.3708000       2.303500     -3.0000001E-04
 C   -2.825700       1.163200      1.9999999E-04
 C   -2.652200      -1.658700      9.9999997E-05
 C    2.576700       1.291400      1.9999999E-04
 C    1.765000       2.423300      3.0000001E-04
 C   -3.981200      0.3736000      6.0000003E-04
 C   -3.893300      -1.016300      6.9999998E-04
 H   0.1597000      -2.163100     -1.2000001E-03
 H  -0.2489000       3.195800     -1.9999999E-04
 H   -2.910700       2.246300      3.0000001E-04
 H   -2.584400      -2.741500       0.000000    
 H    3.652700       1.451900      7.9999998E-04
 H    2.217300       3.411600      8.9999998E-04
 H   -4.957000      0.8520000      1.0000000E-03
 H   -4.802800      -1.611600      1.0000000E-03


%chk=000096730-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096730

0 1
O 4.195570 -0.976970 0.000184
O 2.342278 -2.313138 0.000112
N -0.154134 -1.247670 -0.000102
N 2.914601 -1.136770 -0.000318
C -0.214163 1.055654 0.000167
C 0.637036 -0.110396 -0.000026
C -1.588798 0.561132 0.000182
C -1.512648 -0.874215 0.000008
C 2.047164 0.035331 -0.000101
C 0.364952 2.339448 0.000289
C -2.855374 1.189331 0.000319
C -2.663263 -1.686969 -0.000025
C 2.614017 1.333031 0.000027
C 1.777970 2.469699 0.000210
C -4.013857 0.383353 0.000285
C -3.916783 -1.036534 0.000116
H 0.255261 -2.184459 -0.000213
H -0.266968 3.234111 0.000433
H -2.941441 2.281386 0.000450
H -2.594467 -2.779497 -0.000152
H 3.703513 1.424383 -0.000028
H 2.231264 3.465545 0.000293
H -5.003026 0.853019 0.000391
H -4.832704 -1.637403 0.000098


