%chk=000054983.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054983

0 1
 O   0.9662000      -4.119000       1.096200    
 O   0.9687000      -4.117900      -1.099100    
 O   -5.164400     -0.5056000       1.097400    
 O   -5.163800     -0.5072000      -1.097900    
 N    1.218700      -3.567900     -8.9999998E-04
 N   -4.563500     -0.5396000     -9.9999997E-05
 C  -9.9900000E-02   1.531900      9.9999997E-05
 C    1.307500       1.417800      9.9999997E-05
 C  -0.9069000      0.3693000      1.9999999E-04
 C    1.916900      0.1406000      3.9999999E-04
 C    1.120800      -1.035300      6.0000003E-04
 C  -0.3104000     -0.9193000      6.0000003E-04
 C  -0.6996000       2.815800     -3.9999999E-04
 C    2.106000       2.588500       0.000000    
 C   -2.321000      0.5148000      9.9999997E-05
 C    3.336100      5.6600001E-02  3.9999999E-04
 C    1.808900      -2.273300      5.0000002E-04
 C   -1.188600      -2.030500      1.2000001E-03
 C   0.1066000       3.959100     -6.9999998E-04
 C    1.494300       3.846700     -3.9999999E-04
 C   -2.092600       2.929200     -7.9999998E-04
 C   -2.893900       1.791300     -3.9999999E-04
 C    3.499100       2.476300      1.9999999E-04
 C   -3.139100     -0.6176000      3.9999999E-04
 C    4.106800       1.224300      1.9999999E-04
 C    3.961300      -1.192600      5.0000002E-04
 C   -2.575600      -1.884200      1.1000000E-03
 C    3.201400      -2.352100      3.9999999E-04
 H  -0.9071000      -3.065400      1.5000000E-03
 H  -0.3374000       4.952500     -1.0000000E-03
 H    2.092300       4.755800     -6.0000003E-04
 H   -2.571100       3.906400     -1.2000001E-03
 H   -3.970500       1.943600     -6.0000003E-04
 H    4.129000       3.363400      9.9999997E-05
 H    5.193800       1.172900      3.0000001E-04
 H    5.045900      -1.274900      3.9999999E-04
 H   -3.201000      -2.774400      1.4000000E-03
 H    3.717500      -3.310300      1.9999999E-04


%chk=000054983-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054983

0 1
O 1.008315 -4.206571 1.140665
O 1.008092 -4.205328 -1.142499
O -5.249173 -0.453812 1.142308
O -5.249126 -0.457684 -1.142619
N 1.230295 -3.650226 -0.000646
N -4.656180 -0.511712 -0.000052
C -0.114513 1.544556 -0.000197
C 1.318790 1.424352 0.000091
C -0.936346 0.359503 -0.000017
C 1.940887 0.121333 0.000288
C 1.133823 -1.085582 0.000290
C -0.343933 -0.962104 0.000423
C -0.718203 2.848087 -0.000547
C 2.126813 2.613923 0.000065
C -2.373190 0.524692 -0.000158
C 3.385633 0.052725 0.000397
C 1.866773 -2.304359 0.000000
C -1.224175 -2.077043 0.001075
C 0.111185 4.013878 -0.000589
C 1.497288 3.899228 -0.000267
C -2.152591 2.966845 -0.000807
C -2.956473 1.844460 -0.000599
C 3.562361 2.503445 0.000324
C -3.175316 -0.645726 0.000195
C 4.169801 1.263336 0.000470
C 4.034959 -1.210369 0.000352
C -2.625723 -1.927741 0.000873
C 3.277639 -2.382281 0.000073
H -0.865498 -3.100988 0.001928
H -0.365615 5.000080 -0.000851
H 2.129144 4.794203 -0.000283
H -2.596429 3.968193 -0.001103
H -4.045635 1.948653 -0.000697
H 4.160419 3.421244 0.000349
H 5.261377 1.173063 0.000609
H 5.128377 -1.259252 0.000425
H -3.270893 -2.810513 0.001276
H 3.758446 -3.364806 -0.000144


