%chk=000226669.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226669

0 1
 O   -3.893700       1.833500     -0.1539000    
 O    2.262600      -2.012500     -0.3318000    
 O    3.093600       2.450100     -0.6079000    
 O   -1.912200       2.651300      0.6850000    
 O    1.734200      -2.450900       1.865400    
 O    2.562900       2.142100       1.616100    
 N   -2.886400     -0.6744000     -0.3755000    
 C  -0.8716000     -0.1668000      0.4057000    
 C  -0.8901000      -1.554500      9.0999998E-02
 C   0.2696000      0.5991000      0.9530000    
 C   -2.165400      -1.847100     -0.3970000    
 C   -2.113000      0.3465000      0.1081000    
 C   5.8600001E-02  -2.592900      0.1748000    
 C    1.167100       1.202300     -0.1402000    
 C   -2.540900      -3.131500     -0.8069000    
 C  -0.3027000      -3.882500     -0.2315000    
 C   -1.583200      -4.145400     -0.7145000    
 C   -2.584600       1.689200      0.2492000    
 C    1.402200      -2.355400      0.6757000    
 C    2.337400       1.974200      0.4256000    
 C   -4.481200       3.135800     -6.1600000E-02
 C    3.621600      -1.753900      3.6699999E-02
 C    4.246400       3.209400     -0.2294000    
 C   -5.911700       3.067200     -0.5520000    
 C    4.409300      -1.394000      -1.204900    
 C    4.971300       3.661100      -1.479300    
 H  -8.2900003E-02   1.398200       1.615700    
 H   0.8730000     -2.5400000E-02   1.618400    
 H   -3.847800     -0.5840000     -0.6745000    
 H   0.5778000       1.894500     -0.7538000    
 H    1.553600      0.4167000     -0.7956000    
 H   -3.537400      -3.337100      -1.183000    
 H   0.4169000      -4.696100     -0.1732000    
 H   -1.842800      -5.154400      -1.024700    
 H   -4.460300       3.469600      0.9814000    
 H   -3.908600       3.836200     -0.6791000    
 H    3.653900     -0.9248000      0.7519000    
 H    4.048600      -2.649800      0.5005000    
 H    4.910600       2.585000      0.3785000    
 H    3.933200       4.082800      0.3534000    
 H   -5.947200       2.715300      -1.588300    
 H   -6.490000       2.354600      4.5400001E-02
 H   -6.392100       4.047900     -0.4951000    
 H    4.368400      -2.207300      -1.936800    
 H    3.982600     -0.5091000      -1.688800    
 H    5.455400      -1.191200     -0.9591000    
 H    5.860300       4.245500      -1.226200    
 H    4.313600       4.271300      -2.107000    
 H    5.274700       2.798300      -2.081500    


%chk=000226669-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226669

0 1
O -3.611069 1.897103 -0.271308
O 2.179172 -1.883622 0.120380
O 2.809161 3.054793 -0.686212
O -1.508531 2.730274 0.349123
O 1.966145 -4.009164 1.042838
O 3.447764 1.420967 0.840283
N -2.790714 -0.626510 -0.402037
C -0.615896 -0.269207 0.268954
C -0.805201 -1.697257 0.041083
C 0.590565 0.509616 0.739136
C -2.191752 -1.873772 -0.360695
C -1.855744 0.344042 -0.023116
C -0.014124 -2.895974 0.165835
C 1.353986 1.152344 -0.454919
C -2.787767 -3.126648 -0.623476
C -0.631038 -4.147370 -0.066237
C -1.989823 -4.269600 -0.460428
C -2.242639 1.753739 0.050562
C 1.441108 -2.997050 0.509736
C 2.625819 1.848683 -0.009690
C -4.141326 3.292190 -0.238008
C 3.651952 -1.913465 0.421603
C 4.050911 3.819435 -0.347861
C -5.621063 3.214855 -0.599375
C 4.418986 -2.480228 -0.775258
C 4.029070 5.087249 -1.195591
H 0.256854 1.323652 1.406774
H 1.284158 -0.135468 1.294543
H -3.758302 -0.406030 -0.631049
H 0.713497 1.873702 -0.986416
H 1.640339 0.348041 -1.159205
H -3.836676 -3.201184 -0.929873
H -0.017511 -5.044125 0.063580
H -2.410672 -5.264000 -0.641025
H -3.973452 3.702495 0.774088
H -3.561198 3.900432 -0.955444
H 3.891953 -0.858103 0.625421
H 3.805105 -2.528750 1.324771
H 4.925039 3.178182 -0.563254
H 4.040740 4.032087 0.736367
H -5.761508 2.788996 -1.607857
H -6.173894 2.592737 0.125414
H -6.060093 4.229064 -0.589005
H 4.155234 -3.537086 -0.950609
H 4.206977 -1.902004 -1.691625
H 5.505646 -2.423457 -0.577161
H 4.925614 5.697247 -0.981046
H 3.133967 5.692549 -0.972801
H 4.023832 4.842298 -2.271510


