%chk=000058888.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058888

0 1
 O   0.5005000      -2.253900     -0.8615000    
 N    1.588400      0.1259000     -0.4712000    
 C    2.742100      0.8645000      -1.033200    
 C    4.018400      0.5090000       1.142900    
 C    4.055600      0.3825000     -0.3827000    
 C    2.781800     -0.2092000       1.682800    
 C    1.514300      0.2886000      0.9909000    
 C   0.3136000      0.5389000      -1.065300    
 C    2.871100      0.6920000      -2.553600    
 C    5.293500     -4.6799999E-02   1.771500    
 C  -0.8375000     -0.2850000     -0.5520000    
 C   -2.039900      0.3185000     -0.1602000    
 C  -0.6683000      -1.665100     -0.4799000    
 C   -3.095000     -0.4960000      0.3157000    
 C   -1.705800      -2.466000     -1.1800000E-02
 C   -2.223000       1.709100     -0.2282000    
 C   -2.911700      -1.886800      0.3837000    
 C   -4.302100      0.1042000      0.7097000    
 C   -3.429100       2.288400      0.1673000    
 C   -4.466600       1.487500      0.6353000    
 H    2.630100       1.937700     -0.8246000    
 H    3.947400       1.573500       1.403100    
 H    4.897000      0.9696000     -0.7724000    
 H    4.244600     -0.6631000     -0.6633000    
 H    2.696000     -4.2800002E-02   2.763400    
 H    2.877500      -1.293000       1.534300    
 H   0.6894000     -0.2760000       1.437000    
 H    1.350900       1.343400       1.251700    
 H   0.3150000      0.3874000      -2.151400    
 H   0.2153000       1.612500     -0.9072000    
 H    3.812700       1.121800      -2.913600    
 H    2.857800     -0.3660000      -2.838200    
 H    2.068500       1.205700      -3.091500    
 H    5.270000      6.6600002E-02   2.860400    
 H    5.419900      -1.110800       1.544700    
 H    6.174200      0.4858000       1.397400    
 H   -1.583600      -3.544200      4.8500001E-02
 H   -1.476500       2.402800     -0.5947000    
 H   -3.709000      -2.532200      0.7464000    
 H   -5.126500     -0.5025000       1.078500    
 H   -3.560500       3.365000      0.1065000    
 H    1.070000      -1.626300      -1.332500    
 H   -5.405600       1.939200      0.9421000    


%chk=000058888-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000058888

0 1
O 0.643467 -2.033899 -0.526183
N 1.629855 0.295477 -0.292143
C 2.820246 0.866051 -1.022686
C 4.273217 0.382917 1.071125
C 4.116761 0.230432 -0.459448
C 3.003161 -0.167862 1.758788
C 1.739901 0.497059 1.192035
C 0.297205 0.814321 -0.779328
C 2.736458 0.616506 -2.544299
C 5.554524 -0.307054 1.583172
C -0.852372 -0.103063 -0.365552
C -2.182473 0.400385 -0.133718
C -0.618231 -1.500991 -0.310943
C -3.256623 -0.534469 0.162109
C -1.684255 -2.414860 -0.024396
C -2.519817 1.798882 -0.193959
C -2.969579 -1.940220 0.205705
C -4.582095 -0.045797 0.393021
C -3.824995 2.245362 0.035133
C -4.871633 1.319691 0.334069
H 2.856054 1.967425 -0.833170
H 4.341340 1.468891 1.303183
H 4.980582 0.692927 -0.975583
H 4.121603 -0.848094 -0.721185
H 3.045761 0.008547 2.850942
H 2.940966 -1.263946 1.605938
H 0.831559 0.070210 1.652274
H 1.750430 1.589384 1.417431
H 0.337994 0.857462 -1.882433
H 0.147337 1.851222 -0.413330
H 3.713343 0.848190 -3.005211
H 2.503981 -0.444090 -2.751430
H 1.983122 1.244516 -3.049774
H 5.668225 -0.178842 2.675793
H 5.525776 -1.393290 1.372601
H 6.457694 0.107329 1.097264
H -1.444324 -3.482120 0.002465
H -1.746802 2.538229 -0.428363
H -3.785435 -2.640063 0.422969
H -5.374693 -0.770847 0.616133
H -4.049697 3.317036 -0.016527
H 1.307200 -1.186975 -0.508749
H -5.889839 1.682428 0.511061


