%chk=000126400.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126400

0 1
 O    2.132900      -2.936900     -5.0000002E-04
 O   -5.694400     -0.4062000       0.000000    
 O   -4.283600      -2.093600     -3.9999999E-04
 N    1.894100      -1.670900     -3.0000001E-04
 N   -4.531300     -0.8673000      1.9999999E-04
 C   0.3000000      0.1603000     -1.9999999E-04
 C   -1.058800      0.5759000       0.000000    
 C    1.356100       1.100300     -3.0000001E-04
 C   0.5809000      -1.222200     -9.9999997E-05
 C   -2.102200     -0.3834000      1.9999999E-04
 C   -1.377300       1.950700     -9.9999997E-05
 C    2.708000      0.6284000     -9.9999997E-05
 C    2.949300     -0.7678000     -9.9999997E-05
 C   0.9942000       2.466700     -3.0000001E-04
 C  -0.4535000      -2.163800      1.9999999E-04
 C  -0.3399000       2.884100     -1.9999999E-04
 C   -1.782500      -1.746800      3.9999999E-04
 C   -3.436900      4.7400001E-02  3.9999999E-04
 C   -2.721300       2.352700       0.000000    
 C   -3.743400       1.406400      1.9999999E-04
 C    3.853300       1.462700     -9.9999997E-05
 C    4.253800      -1.285800      1.9999999E-04
 C    5.151400      0.9414000      5.0000002E-04
 C    5.351100     -0.4322000      5.0000002E-04
 H    1.750200       3.248100     -3.0000001E-04
 H  -0.2535000      -3.232800      3.9999999E-04
 H  -0.5531000       3.951100     -1.9999999E-04
 H   -2.422800      -2.610300      1.0000000E-03
 H   -2.983100       3.408700     -9.9999997E-05
 H   -4.765100       1.778000      1.9999999E-04
 H    3.759600       2.545700     -1.9999999E-04
 H    4.449400      -2.355100      1.9999999E-04
 H    6.004000       1.614400      6.9999998E-04
 H    6.358400     -0.8374000      8.9999998E-04


%chk=000126400-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126400

0 1
O 2.213703 -3.018546 0.000222
O -5.844761 -0.257116 0.000602
O -4.544242 -2.117820 0.000084
N 1.938836 -1.717130 0.000175
N -4.679601 -0.828496 -0.000075
C 0.314023 0.135017 0.000055
C -1.071315 0.539585 -0.000002
C 1.368323 1.107230 0.000034
C 0.615792 -1.270627 0.000134
C -2.136079 -0.449472 0.000006
C -1.375004 1.950217 -0.000067
C 2.742224 0.631083 0.000095
C 3.010619 -0.779903 0.000167
C 1.024369 2.497532 -0.000046
C -0.431543 -2.240388 0.000178
C -0.303603 2.905185 -0.000092
C -1.759996 -1.849528 0.000115
C -3.484305 0.046328 -0.000055
C -2.737064 2.373169 -0.000104
C -3.770296 1.438310 -0.000088
C 3.878186 1.501226 0.000094
C 4.334801 -1.295047 0.000231
C 5.183346 0.998154 0.000154
C 5.416014 -0.409248 0.000226
H 1.812717 3.254999 -0.000070
H -0.147972 -3.295175 0.000259
H -0.553771 3.971538 -0.000149
H -2.549380 -2.598739 0.000133
H -2.965649 3.443971 -0.000149
H -4.818379 1.744915 -0.000116
H 3.729019 2.584420 0.000041
H 4.462092 -2.379758 0.000282
H 6.032461 1.689574 0.000148
H 6.440432 -0.794960 0.000277


