%chk=000022938.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022938

0 1
 O    3.521400      9.9999997E-05 -0.2103000    
 N   0.7057000     -3.9999999E-04  0.2058000    
 C  -0.6749000     -3.0000001E-04 -0.2733000    
 C   -1.394300      -1.264300      0.2106000    
 C   -1.393900       1.264100      0.2097000    
 C   -2.863900      -1.262600     -0.2067000    
 C   -2.863300       1.262700     -0.2084000    
 C   -3.580800      5.0000002E-04  0.2619000    
 C    1.415200       1.204100     -0.2471000    
 C    1.415800      -1.203900     -0.2491000    
 C    2.856500       1.175600      0.2539000    
 C    2.856500      -1.175600      0.2531000    
 H  -0.6887000     -6.9999998E-04  -1.373300    
 H   -1.328100      -1.350600       1.303100    
 H  -0.9675000      -2.175500     -0.2193000    
 H  -0.9669000       2.175000     -0.2207000    
 H   -1.328200       1.351100       1.302100    
 H   -3.366100      -2.144900      0.2063000    
 H   -2.934200      -1.337300      -1.299100    
 H   -2.933100       1.335800      -1.300900    
 H   -3.365100       2.145700      0.2033000    
 H   -4.610700      5.0000002E-04 -0.1124000    
 H   -3.638600      1.2000001E-03   1.357300    
 H   0.9857000       2.122100      0.1619000    
 H    1.407700       1.268800      -1.342800    
 H    1.408900      -1.266500      -1.344800    
 H   0.9861000      -2.122700      0.1577000    
 H    3.403900       2.041100     -0.1335000    
 H    2.906000       1.215200       1.349000    
 H    2.905400      -1.215800       1.348300    
 H    3.404100      -2.040800     -0.1344000    


%chk=000022938-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000022938

0 1
O 3.661142 0.001403 -0.169336
N 0.737984 -0.001148 0.169592
C -0.693506 -0.001233 -0.296608
C -1.442973 -1.265790 0.200309
C -1.441286 1.264844 0.198716
C -2.937730 -1.264242 -0.202579
C -2.935994 1.264825 -0.204324
C -3.664808 0.001145 0.299941
C 1.487094 1.210600 -0.270299
C 1.488954 -1.211128 -0.272234
C 2.925026 1.194196 0.272780
C 2.926930 -1.193345 0.270714
H -0.724537 -0.001757 -1.421800
H -1.348385 -1.307112 1.304579
H -0.976404 -2.182943 -0.203074
H -0.973211 2.180830 -0.205685
H -1.346793 1.307357 1.302951
H -3.425114 -2.176233 0.193230
H -3.019535 -1.313820 -1.308490
H -3.017650 1.313001 -1.310311
H -3.422124 2.178032 0.190216
H -4.719278 0.001655 -0.038006
H -3.679560 0.001918 1.409228
H 0.990918 2.115990 0.118149
H 1.517796 1.285720 -1.388023
H 1.519681 -1.284431 -1.390084
H 0.994417 -2.117957 0.114826
H 3.497919 2.055603 -0.109475
H 2.899187 1.226187 1.384098
H 2.901252 -1.227311 1.381975
H 3.501188 -2.053158 -0.113077


