%chk=000064204.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064204

1 1
 O    1.462100      -1.160400      0.2606000    
 N   0.4746000      0.9398000      0.3192000    
 N    3.973800      6.3600004E-02 -9.0400003E-02
 C  -0.8881000      0.4828000      0.1465000    
 C   -2.726800     -0.9543000       1.118000    
 C   -3.302700       1.205000     -4.9400002E-02
 C   -2.467700     -0.7654000      -1.383100    
 C   -1.278700     -0.4647000       1.301800    
 C   -1.853000       1.688800      0.1376000    
 C   -1.020300     -0.2766000      -1.193000    
 C   -3.673300      0.2582000       1.104800    
 C   -2.842500      -1.701600     -0.2215000    
 C   -3.415300      0.4464000      -1.382700    
 C    1.543700      6.0899999E-02  0.3612000    
 C    2.850100      0.7907000      0.5473000    
 C    3.736900     -9.3599997E-02  -1.599400    
 C    5.295900      0.8190000      0.1076000    
 C    4.131500      -1.338600      0.5150000    
 H   -2.997900      -1.625100       1.941000    
 H   -3.981200       2.065300     -5.4699998E-02
 H   -2.555100      -1.301900      -2.334400    
 H   -1.181200      5.3599998E-02   2.265000    
 H  -0.6266000      -1.342200       1.361300    
 H   -1.585800       2.385200     -0.6681000    
 H   -1.766700       2.253300       1.075300    
 H  -0.3567000      -1.145600      -1.248600    
 H  -0.7364000      0.3779000      -2.027900    
 H   -4.711300     -7.8500003E-02  0.9940000    
 H   -3.611900      0.7917000       2.061300    
 H   -2.183300      -2.578300     -0.2195000    
 H   -3.865900      -2.072900     -0.3556000    
 H   -4.448900      0.1132000      -1.537500    
 H   -3.168100       1.115300      -2.216300    
 H   0.6416000       1.936300      0.4257000    
 H    3.056000      0.8871000       1.619600    
 H    2.806600       1.792500      0.1041000    
 H    4.611100     -0.5915000      -2.030500    
 H    2.844300     -0.6969000      -1.779100    
 H    3.618400      0.9051000      -2.030200    
 H    6.094900      0.2717000     -0.4012000    
 H    5.184200       1.818700     -0.3222000    
 H    5.492100      0.8817000       1.181900    
 H    5.162200      -1.667100      0.3425000    
 H    3.943300      -1.285000       1.591100    
 H    3.476800      -2.054100      1.4000000E-02


%chk=000064204-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064204

1 1
O 1.565954 -1.203635 -0.165201
N 0.461310 0.842488 0.135121
N 4.163837 0.047332 -0.062152
C -0.970775 0.381251 0.034494
C -2.791236 -1.055909 1.055847
C -3.357426 1.238250 0.137268
C -2.751086 -0.646089 -1.446951
C -1.292108 -0.653951 1.150554
C -1.859482 1.641119 0.227308
C -1.251834 -0.241272 -1.363264
C -3.679006 0.202690 1.248618
C -3.069445 -1.683804 -0.336765
C -3.639017 0.613453 -1.255687
C 1.566120 0.049674 0.058635
C 2.893415 0.829199 0.312688
C 4.115508 -0.410378 -1.525236
C 5.360278 0.981537 0.126554
C 4.339159 -1.173646 0.854035
H -3.011007 -1.794626 1.849779
H -3.978766 2.142989 0.275813
H -2.942651 -1.091567 -2.441599
H -1.078756 -0.206743 2.142038
H -0.648279 -1.543843 1.030337
H -1.627140 2.391949 -0.556601
H -1.655150 2.101141 1.216599
H -0.605202 -1.124422 -1.513331
H -1.011298 0.497930 -2.153522
H -4.748802 -0.076827 1.200856
H -3.503957 0.646143 2.249246
H -2.452829 -2.593605 -0.475282
H -4.129475 -1.995218 -0.404468
H -4.707923 0.337411 -1.332635
H -3.434596 1.351709 -2.056574
H 0.586719 1.847696 0.296881
H 2.982770 1.077042 1.385758
H 2.916391 1.768885 -0.267692
H 5.081373 -0.875887 -1.774073
H 3.295519 -1.132585 -1.633821
H 3.946364 0.468408 -2.167260
H 6.283739 0.419133 -0.077908
H 5.276934 1.827100 -0.573411
H 5.373725 1.350424 1.163712
H 5.262349 -1.696282 0.560124
H 4.420086 -0.824568 1.895546
H 3.460396 -1.820595 0.726722


