%chk=000082094.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082094

0 1
 O   -2.671200       2.290500      1.1000000E-03
 O    2.671600       2.290000     -1.6000000E-03
 N   -2.808100     -0.3162000      8.9999998E-04
 N    2.808000     -0.3165000     -3.9999999E-04
 C  -0.6982000      0.9774000      8.9999998E-04
 C   0.6982000      0.9772000      3.0000001E-04
 C   -1.396500     -0.2362000      1.8000000E-03
 C    1.396500     -0.2363000      1.3000000E-03
 C  -0.6979000       3.523500     -9.9999997E-05
 C   0.6985000       3.523300     -8.9999998E-04
 C   -1.447400       2.250400      1.3000000E-03
 C    1.447600       2.250100     -7.9999998E-04
 C  -0.6969000      -1.443300      2.9000000E-03
 C   0.6965000      -1.443300      2.6000000E-03
 C   -3.698400      -1.404500     -9.9999997E-05
 C    3.698100      -1.404800     -9.9999997E-05
 C   -1.396100       4.737000     -3.0000001E-04
 C    1.396800       4.736800     -1.6000000E-03
 C   -4.143500      -1.950800      -1.208500    
 C    4.145400      -1.950100       1.208000    
 C   -4.146700      -1.950400       1.207500    
 C    4.144200      -1.951900      -1.208000    
 C  -0.6963000       5.943900     -8.9999998E-04
 C   0.6972000       5.943800     -1.3000000E-03
 C   -5.026600      -3.030500      -1.209400    
 C    5.028500      -3.030000       1.208300    
 C   -5.029600      -3.030300       1.206500    
 C    5.027000      -3.031900      -1.207700    
 C   -3.686300      -1.394400      -2.517900    
 C    3.690600      -1.392500       2.517700    
 C   -3.693200      -1.393200       2.517800    
 C    3.688300      -1.395700      -2.518000    
 C   -5.469600      -3.570400     -2.0000001E-03
 C    5.469200      -3.570900      3.9999999E-04
 H   -1.205300      -2.403700      3.5999999E-03
 H    1.204800      -2.403800      3.1000001E-03
 H   -3.292300      0.5743000      5.2000000E-03
 H    3.292300      0.5740000      1.1000000E-03
 H   -2.482300       4.766700      3.0000001E-04
 H    2.483100       4.766300     -2.0999999E-03
 H   -1.238500       6.885100     -8.9999998E-04
 H    1.239600       6.885000     -1.7000000E-03
 H   -5.378400      -3.464400      -2.141600    
 H    5.382100      -3.463100       2.140200    
 H   -5.383800      -3.463900       2.137900    
 H    5.379500      -3.466300      -2.139400    
 H   -2.620100      -1.593700      -2.666300    
 H   -4.225900      -1.841500      -3.360000    
 H   -3.863000     -0.3145000      -2.563500    
 H    3.867700     -0.3126000       2.562200    
 H    4.231500      -1.839100       3.359200    
 H    2.624600      -1.591300       2.668100    
 H   -3.871400     -0.3135000       2.562700    
 H   -2.627200      -1.591000       2.668700    
 H   -4.234200      -1.840900       3.358700    
 H    2.621900      -1.593700      -2.666700    
 H    4.227600      -1.844200      -3.359500    
 H    3.866600     -0.3161000      -2.564100    
 H   -6.156500      -4.411600     -2.7000001E-03
 H    6.156100      -4.412200      6.0000003E-04


%chk=000082094-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000082094

0 1
O -2.780529 2.263926 0.238568
O 2.766663 2.279270 0.232765
N -2.823399 -0.288811 0.041039
N 2.823278 -0.273139 0.034922
C -0.728056 0.978207 0.125191
C 0.721127 0.982288 0.123543
C -1.442917 -0.272585 0.063003
C 1.442791 -0.264467 0.059877
C -0.723235 3.508738 0.256728
C 0.702519 3.512743 0.255074
C -1.475929 2.234222 0.205730
C 1.462197 2.242459 0.202008
C -0.689010 -1.499902 0.075997
C 0.695808 -1.495978 0.074477
C -3.663485 -1.446324 -0.069652
C 3.669533 -1.426004 -0.077600
C -1.429204 4.738921 0.315817
C 1.401675 4.746887 0.312562
C -3.660478 -2.243624 -1.254730
C 4.570813 -1.696333 0.997336
C -4.561379 -1.721082 1.007005
C 3.668891 -2.222692 -1.263084
C -0.727832 5.956834 0.369709
C 0.693564 5.960828 0.368068
C -4.540646 -3.352783 -1.317962
C 5.445077 -2.802986 0.885707
C -5.429253 -2.832949 0.897764
C 4.555480 -3.326573 -1.328734
C -2.784353 -1.897254 -2.444808
C 4.585965 -0.812560 2.231025
C -4.579495 -0.836498 2.240059
C 2.788373 -1.880757 -2.451224
C -5.414358 -3.653542 -0.251571
C 5.433034 -3.622782 -0.264205
H -1.233591 -2.448142 0.121444
H 1.245902 -2.441098 0.118695
H -3.231056 0.675649 0.161106
H 3.225932 0.693580 0.154015
H -2.522709 4.703453 0.318365
H 2.495366 4.717583 0.312539
H -1.276369 6.904058 0.413787
H 1.236865 6.911125 0.410868
H -4.550934 -3.970356 -2.223960
H 6.134186 -3.023414 1.709259
H -6.115670 -3.056727 1.722654
H 4.567517 -3.943579 -2.235089
H -1.738421 -2.231732 -2.304804
H -3.167205 -2.376620 -3.361721
H -2.747488 -0.805720 -2.608971
H 4.984475 0.195307 2.005840
H 5.216302 -1.252086 3.022398
H 3.568409 -0.664738 2.635910
H -4.980685 0.170131 2.014135
H -3.562495 -0.685539 2.645269
H -5.208846 -1.277266 3.031513
H 1.743228 -2.215726 -2.306783
H 3.168626 -2.362347 -3.368042
H 2.749870 -0.789692 -2.618351
H -6.089813 -4.513319 -0.321586
H 6.113575 -4.478382 -0.336095


