%chk=000098147.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000098147

0 1
 O    3.943100      0.2154000     -6.1500002E-02
 O    2.657600       1.885500      0.8652000    
 N  -0.7976000     -0.3430000      0.1881000    
 N    2.022700      -2.421900      -1.102400    
 C   -2.003300      -2.350600      0.9464000    
 C   -3.313700      -1.861100      0.3538000    
 C  -0.8466000      -1.812400      0.1203000    
 C   -3.269900     -0.3801000      7.1199998E-02
 C   -2.041900      0.3231000     -1.3900000E-02
 C   -4.492900      0.2821000     -0.1398000    
 C   -2.113100       1.703700     -0.2965000    
 C   0.4035000      0.2900000      0.3561000    
 C   -4.525000       1.644000     -0.4167000    
 C   -3.335400       2.354300     -0.4939000    
 C    1.636900     -0.1261000      2.5200000E-02
 C    2.773300      0.7897000      0.3348000    
 C    1.849200      -1.392200     -0.5960000    
 C    5.125100      0.9871000      0.1771000    
 C    6.328000      0.2125000     -0.3174000    
 H   -1.911800      -2.008200       1.985700    
 H   -1.989200      -3.446100      0.9619000    
 H   -4.128900      -2.092000       1.049700    
 H   -3.515700      -2.387200     -0.5873000    
 H   2.3200000E-02  -2.274700      0.5940000    
 H  -0.9154000      -2.150000     -0.9213000    
 H   -5.429100     -0.2686000     -8.5400000E-02
 H   -1.213000       2.306400     -0.3921000    
 H   0.2816000       1.271000      0.8059000    
 H   -5.473900       2.147200     -0.5747000    
 H   -3.351400       3.417700     -0.7150000    
 H    5.052800       1.940300     -0.3584000    
 H    5.224500       1.179600       1.251100    
 H    7.251000      0.7747000     -0.1503000    
 H    6.403100     -0.7517000      0.1961000    
 H    6.234100     -3.5999999E-03  -1.386800    


%chk=000098147-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000098147

0 1
O 3.985342 0.183519 -0.012068
O 2.490916 1.892829 0.539613
N -0.857645 -0.474241 -0.155267
N 2.416232 -2.681339 -0.962327
C -1.985967 -2.434043 0.839738
C -3.378873 -1.826564 0.586877
C -0.999961 -1.954523 -0.242305
C -3.311100 -0.347886 0.218482
C -2.087033 0.287078 -0.147229
C -4.495025 0.427502 0.219269
C -2.085449 1.654450 -0.533998
C 0.346273 0.159602 -0.008947
C -4.492503 1.792728 -0.131707
C -3.276692 2.404410 -0.514752
C 1.659170 -0.301282 -0.142310
C 2.707370 0.706816 0.167395
C 2.063334 -1.599222 -0.583089
C 5.119670 1.117457 0.261037
C 6.400697 0.327549 0.015448
H -1.601720 -2.133409 1.832148
H -2.035449 -3.537581 0.822851
H -4.026362 -1.959953 1.473271
H -3.871805 -2.376145 -0.241276
H -0.015017 -2.418616 -0.107445
H -1.370002 -2.223427 -1.250461
H -5.435725 -0.057279 0.508704
H -1.164204 2.129880 -0.884212
H 0.284991 1.213731 0.286958
H -5.423617 2.368435 -0.118351
H -3.255900 3.456909 -0.816169
H 5.021437 1.988654 -0.411963
H 5.032226 1.475770 1.302860
H 7.279085 0.972895 0.199645
H 6.460141 -0.544716 0.688208
H 6.445065 -0.035188 -1.025427


