%chk=000055509.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055509

0 1
 O   -1.920400       1.329500      7.9999998E-04
 O   -4.908800     -0.5891000     -2.0999999E-03
 O    2.682900       3.245300     -8.9999998E-04
 O    4.018100       1.497500     -9.9999997E-05
 N    2.877400       2.010000     -6.0000003E-04
 C  -0.5525000     -0.4727000      5.0000002E-04
 C   0.7308000      -1.084000      9.9999997E-05
 C   -1.905700     -0.9173000      6.0000003E-04
 C  -0.6218000      0.9171000      5.0000002E-04
 C    1.883800     -0.2546000     -9.9999997E-05
 C   -2.690200      0.2118000      8.9999998E-04
 C    1.743100       1.143300       0.000000    
 C   0.4873000       1.758700      3.0000001E-04
 C   0.8694000      -2.486200      1.9999999E-04
 C   -2.414000      -2.304000     -6.9999998E-04
 C    3.148800     -0.8624000     -9.9999997E-05
 C   -4.103700      0.3844000     -9.9999997E-05
 C    2.138900      -3.062200      1.9999999E-04
 C    3.273800      -2.253700       0.000000    
 C   -4.737200       1.788500      5.0000002E-04
 H   0.3402000       2.833000      3.9999999E-04
 H   2.0000000E-02  -3.157200      3.0000001E-04
 H   -2.063100      -2.837800      0.8888000    
 H   -3.500500      -2.388100     -6.9999998E-04
 H   -2.063100      -2.836100     -0.8913000    
 H    4.131300     -0.4260000     -9.9999997E-05
 H    2.244100      -4.143400      3.0000001E-04
 H    4.259300      -2.712100       0.000000    
 H   -4.424000       2.328800     -0.8966000    
 H   -4.422900       2.328500      0.8975000    
 H   -5.827300       1.701700      1.3000000E-03


%chk=000055509-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000055509

0 1
O -1.948930 1.365173 0.000125
O -4.995964 -0.612482 -0.000097
O 2.588211 3.405415 -0.000922
O 4.103170 1.720103 0.000638
N 2.882032 2.143997 0.000562
C -0.560244 -0.490904 -0.000028
C 0.739016 -1.122210 -0.000036
C -1.935433 -0.965154 -0.000163
C -0.623039 0.923228 0.000136
C 1.934698 -0.281063 0.000174
C -2.743952 0.182653 -0.000075
C 1.753206 1.168728 0.000337
C 0.488901 1.773521 0.000283
C 0.884786 -2.543744 -0.000256
C -2.443381 -2.381541 -0.000353
C 3.211344 -0.935636 0.000102
C -4.208660 0.383618 -0.000091
C 2.146337 -3.144897 -0.000302
C 3.311707 -2.331478 -0.000135
C -4.714869 1.816460 0.000368
H 0.399478 2.861177 0.000372
H -0.008532 -3.170502 -0.000404
H -2.087564 -2.930048 0.891874
H -3.542946 -2.390608 -0.000426
H -2.087465 -2.929849 -0.892665
H 4.112625 -0.325760 0.000271
H 2.235652 -4.236097 -0.000477
H 4.302911 -2.796898 -0.000178
H -4.342999 2.362913 -0.885486
H -4.341227 2.363184 0.885282
H -5.814867 1.809902 0.001370


