%chk=000048089.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048089

0 1
 O   -7.211100      6.1700001E-02 -0.6459000    
 O  -0.8096000      0.1411000      0.2340000    
 O    1.468500      0.5241000       1.574000    
 O   0.3074000       1.475400      -1.269500    
 O    1.535400       2.685900      0.7623000    
 N   -4.477400      0.4433000      4.9300000E-02
 C   -5.508600      0.2310000       1.074500    
 C   -4.866700     -0.2224000      -1.201600    
 C   -3.178300     -4.0600002E-02  0.5119000    
 C   -6.857000      0.7316000      0.5646000    
 C   -6.229700      0.2900000      -1.658000    
 C    1.580000      1.7000001E-02  0.2285000    
 C   -2.051100      0.6271000     -0.2592000    
 C    2.881000      0.5033000     -0.4146000    
 C    1.519200      -1.512000      0.2483000    
 C   0.3183000      0.6507000     -0.3633000    
 C    2.936400      0.7322000      -1.789500    
 C    2.029000      -2.216000       1.339200    
 C    4.011300      0.7181000      0.3743000    
 C   0.9536000      -2.201600     -0.8242000    
 C    4.121900       1.175500      -2.375700    
 C    1.973500      -3.609700       1.357700    
 C    5.196700       1.161600     -0.2120000    
 C   0.8980000      -3.595300     -0.8057000    
 C    1.459800       1.878800       1.678800    
 C    5.252000       1.390300      -1.587000    
 C    1.408100      -4.299300      0.2852000    
 C    1.339600       2.258300       3.123700    
 H   -5.255000      0.7761000       1.990900    
 H   -5.583400     -0.8360000       1.321800    
 H   -4.145400     -2.4599999E-02  -2.000700    
 H   -4.920300      -1.309200      -1.054500    
 H   -3.095600      -1.134400      0.4600000    
 H   -3.031500      0.2108000       1.571500    
 H   -7.636900      0.5188000       1.302700    
 H   -6.848400       1.815100      0.3943000    
 H   -6.199100       1.358400      -1.904300    
 H   -6.548400     -0.2479000      -2.556700    
 H   -2.111000      0.3990000      -1.328600    
 H   -2.092800       1.715000     -0.1240000    
 H    2.098400      0.5227000      -2.446600    
 H    2.481700      -1.702200       2.182700    
 H    4.002700      0.5304000       1.444400    
 H   0.5601000      -1.676600      -1.690100    
 H    4.169500       1.340700      -3.448100    
 H    2.372400      -4.158100       2.206000    
 H    6.078400       1.324200      0.4011000    
 H   0.4601000      -4.132600      -1.641900    
 H    6.176300       1.731500      -2.044000    
 H    1.365800      -5.384400      0.2990000    
 H    2.192800       1.865400       3.682400    
 H    1.337500       3.348400       3.212800    
 H   0.4011000       1.873700       3.531000    


%chk=000048089-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000048089

0 1
O -7.354553 -0.011550 -0.341072
O -0.781794 0.312381 0.163514
O 1.552848 0.481110 1.509146
O 0.237372 0.542482 -1.913962
O 0.911109 2.617734 0.813583
N -4.517758 0.480846 0.046799
C -5.519880 0.906931 1.057947
C -5.000511 -0.722648 -0.681711
C -3.156296 0.316890 0.606944
C -6.867698 1.181839 0.371317
C -6.357590 -0.428176 -1.341209
C 1.620653 -0.002276 0.082656
C -2.103492 0.567528 -0.478801
C 2.904178 0.557804 -0.548495
C 1.607935 -1.543586 0.165147
C 0.316501 0.365817 -0.679668
C 2.915704 1.710063 -1.373291
C 1.280562 -2.226488 1.359121
C 4.137048 -0.057666 -0.207653
C 1.874252 -2.283984 -1.014495
C 4.138480 2.223203 -1.858445
C 1.238604 -3.639446 1.377042
C 5.357895 0.461930 -0.685538
C 1.822965 -3.693717 -0.994829
C 1.223631 1.825040 1.727984
C 5.362767 1.604925 -1.518254
C 1.508078 -4.378142 0.202678
C 1.307973 2.143164 3.203263
H -5.163801 1.832276 1.548783
H -5.667077 0.128555 1.848659
H -4.270955 -1.001678 -1.464267
H -5.111020 -1.595245 0.010750
H -2.993976 -0.692512 1.055855
H -3.012677 1.059060 1.413100
H -7.649218 1.424287 1.110233
H -6.753258 2.024537 -0.344196
H -6.234956 0.370516 -2.104162
H -6.774134 -1.332947 -1.813803
H -2.209135 -0.107750 -1.346252
H -2.133049 1.610529 -0.836763
H 1.978591 2.201819 -1.639554
H 1.068676 -1.651696 2.263536
H 4.138155 -0.946280 0.433072
H 2.117810 -1.756125 -1.943291
H 4.132647 3.110624 -2.500846
H 0.993671 -4.161522 2.308900
H 6.300779 -0.024918 -0.412814
H 2.030152 -4.256125 -1.911902
H 6.309068 2.007955 -1.896659
H 1.472516 -5.473226 0.218914
H 2.341462 1.995374 3.562044
H 1.002289 3.185269 3.374028
H 0.657655 1.461522 3.778121


