%chk=000065396.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065396

0 1
 O   -4.176700      -1.499800     -8.8799998E-02
 O    5.223600       1.233600      -1.370500    
 O    5.321500       1.524100      0.8750000    
 N   -1.545100     -0.3808000     -0.4026000    
 N    4.839400      -1.022700       1.457400    
 N   -7.574700      0.9638000      0.4481000    
 C   0.8799000     -0.7269000     -0.5104000    
 C    2.232400     -0.3097000      7.2600000E-02
 C  -0.2648000      3.4100000E-02  0.1585000    
 C    3.426800      -1.022100     -0.5762000    
 C   -3.992900     -0.1093000     -0.3487000    
 C   -2.644200      0.3444000      0.2188000    
 C   -5.144200      0.6603000      0.3138000    
 C    4.790000     -0.6762000      3.6300000E-02
 C   -6.512500      0.1957000     -0.1920000    
 C    5.141500      0.7916000     -9.1300003E-02
 H   0.7436000      -1.806900     -0.3728000    
 H   0.8739000     -0.5349000      -1.590600    
 H    2.222600     -0.5120000       1.150300    
 H    2.351400      0.7744000     -4.4500001E-02
 H  -0.1191000       1.109900      3.5000001E-03
 H  -0.2451000     -0.1562000       1.238600    
 H    3.439000     -0.7791000      -1.646300    
 H    3.271700      -2.107000     -0.5089000    
 H   -4.020500      3.5599999E-02  -1.434800    
 H   -2.526400       1.421300      4.8799999E-02
 H   -2.628700      0.1659000       1.301500    
 H   -1.673500      -1.383300     -0.2676000    
 H   -5.104300      0.5127000       1.401400    
 H   -5.021600       1.734200      0.1251000    
 H    5.573700      -1.244400     -0.4786000    
 H   -6.666000     -0.8673000      2.1400001E-02
 H   -6.576800      0.3320000      -1.276800    
 H   -4.138400      -1.632600      0.8738000    
 H    5.788600     -0.8975000       1.807800    
 H    4.621500      -2.011400       1.575300    
 H   -7.542300      0.8202000       1.456700    
 H   -8.479700      0.6119000      0.1385000    
 H    5.443500       2.188600      -1.414600    


%chk=000065396-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000065396

0 1
O -4.035689 -1.583077 0.171217
O 5.213127 1.187332 -1.327143
O 5.623678 1.298459 0.953309
N -1.546379 -0.207748 -0.304363
N 4.881451 -1.328082 1.335041
N -7.723518 0.815176 0.327338
C 0.904102 -0.594341 -0.507447
C 2.309659 -0.235584 0.021559
C -0.218360 0.185153 0.205003
C 3.428195 -1.011419 -0.700798
C -4.008702 -0.131899 -0.170239
C -2.684906 0.487579 0.316001
C -5.253052 0.596060 0.369118
C 4.834924 -0.832512 -0.041608
C -6.569547 0.101771 -0.264208
C 5.259488 0.634372 -0.043402
H 0.732302 -1.684050 -0.372811
H 0.834459 -0.396652 -1.594981
H 2.378098 -0.456138 1.104672
H 2.476768 0.855460 -0.098229
H -0.083927 1.271100 0.022349
H -0.119503 0.038148 1.312918
H 3.490752 -0.707415 -1.763046
H 3.199896 -2.095658 -0.677382
H -4.008756 -0.143351 -1.274939
H -2.657344 1.558592 0.031058
H -2.665798 0.454467 1.441073
H -1.694492 -1.227282 -0.269484
H -5.298989 0.471602 1.474273
H -5.163198 1.683159 0.181124
H 5.566732 -1.348254 -0.708008
H -6.617344 -1.008154 -0.171343
H -6.549144 0.330815 -1.347058
H -4.117037 -1.658501 1.158186
H 5.312853 -0.695243 2.012271
H 5.103486 -2.315511 1.450812
H -7.849810 0.632520 1.328874
H -8.600224 0.694752 -0.189501
H 5.502848 2.138553 -1.283008


