%chk=000028532.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028532

0 1
 O    3.491400      0.3624000     -1.0000000E-03
 O    2.704800      -1.687100      3.0000001E-04
 N    2.530400     -0.4445000     -1.9999999E-04
 N   -2.707600       1.601100     -3.0000001E-04
 N   -3.160100      -1.985200     -3.0000001E-04
 C    1.204700      6.4400002E-02  5.0000002E-04
 C   -1.399200       1.065700       0.000000    
 C   -1.181800     -0.3122000      9.9999997E-05
 C   0.1202000     -0.8128000      5.0000002E-04
 C   0.9872000       1.442200      3.0000001E-04
 C  -0.3147000       1.942900      1.9999999E-04
 C   -2.275300      -1.236900     -9.9999997E-05
 H   0.2695000      -1.891000      5.0000002E-04
 H    1.807700       2.155200      3.0000001E-04
 H  -0.4698000       3.018900      9.9999997E-05
 H   -2.838400       2.604300      1.9999999E-04
 H   -3.516100      0.9947000      3.0000001E-04


%chk=000028532-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000028532

0 1
O 3.556171 0.402608 -0.000096
O 2.750398 -1.736131 -0.000014
N 2.584120 -0.452673 0.000123
N -2.720907 1.575823 0.000062
N -3.294926 -1.913498 0.000310
C 1.209441 0.068682 0.000107
C -1.433606 1.087729 0.000080
C -1.189348 -0.335653 0.000060
C 0.131200 -0.834974 0.000077
C 0.996155 1.471299 0.000118
C -0.309210 1.970665 0.000108
C -2.316424 -1.223297 0.000020
H 0.326490 -1.910342 0.000072
H 1.862281 2.138280 0.000136
H -0.479601 3.052619 0.000126
H -2.898202 2.577257 0.000069
H -3.521133 0.943707 0.000040


