%chk=000071863.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071863

0 1
 O  -0.6632000      -1.383700     -0.1719000    
 O   -2.496500      -1.764900      -1.525000    
 O    2.129000      -1.303400     -0.4071000    
 N    5.435800      1.0000000E-03  0.5391000    
 C   -2.567100     -5.2099999E-02  0.1829000    
 C   -2.725100     -0.4967000       1.650000    
 C   -4.041800      0.1102000     -0.2339000    
 C   -3.949900      -1.407600       1.674600    
 C   -4.796400      -1.015200      0.4701000    
 C   -1.722500       1.201500     -4.4999998E-03
 C   -1.932900      -1.166300     -0.6188000    
 C  -0.6666000       1.468200      0.8672000    
 C   -2.005200       2.083400      -1.047700    
 C   0.1064000       2.616600      0.6955000    
 C   -1.232000       3.231600      -1.219300    
 C   5.7399999E-02  -2.419500     -0.8473000    
 C  -0.1763000       3.498100     -0.3478000    
 C    1.441500      -2.537200     -0.2386000    
 C    3.428200      -1.349000      0.1661000    
 C    4.104500     -4.4000000E-03 -4.8799999E-02
 C    5.881100       1.371800      0.8008000    
 C    6.391500     -0.6826000     -0.3357000    
 H   -2.920800      0.3700000       2.295800    
 H   -1.853900      -1.018500       2.060900    
 H   -4.211700      7.5900003E-02  -1.315800    
 H   -4.437200       1.070500      0.1244000    
 H   -3.646400      -2.457500       1.589400    
 H   -4.503600      -1.303900       2.613300    
 H   -5.798400     -0.6901000      0.7689000    
 H   -4.922100      -1.875700     -0.1967000    
 H  -0.4130000      0.7972000       1.682200    
 H   -2.810400       1.896200      -1.751600    
 H   0.9311000       2.822400       1.371700    
 H   -1.449500       3.916400      -2.033900    
 H  -0.4794000      -3.368700     -0.7431000    
 H   0.1393000      -2.153200      -1.907500    
 H   0.4269000       4.391200     -0.4824000    
 H    1.997200      -3.343800     -0.7290000    
 H    1.355600      -2.752900      0.8327000    
 H    3.990800      -2.158500     -0.3108000    
 H    3.345900      -1.563700       1.238700    
 H    3.467400      0.7509000      0.4324000    
 H    4.113800      0.2638000      -1.113700    
 H    5.205600       1.869200       1.505800    
 H    5.929100       1.971600     -0.1154000    
 H    6.872700       1.372400       1.267100    
 H    7.390800     -0.6753000      0.1151000    
 H    6.132300      -1.736600     -0.4741000    
 H    6.462000     -0.2099000      -1.322300    


%chk=000071863-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000071863

0 1
O -0.704645 -1.377214 -0.319691
O -2.422677 -1.374096 -1.881772
O 2.228154 -1.372042 -0.506414
N 5.549715 -0.333731 0.875650
C -2.601833 0.083849 0.137014
C -2.370560 -0.263234 1.642984
C -4.146463 -0.046129 0.022843
C -3.346003 -1.437228 1.931670
C -4.503307 -1.293947 0.881621
C -2.012507 1.454406 -0.261388
C -1.949150 -0.960022 -0.798866
C -0.642872 1.736425 -0.005198
C -2.802092 2.449743 -0.890538
C -0.089059 2.988863 -0.345725
C -2.247231 3.704741 -1.231633
C 0.092027 -2.242722 -1.229901
C -0.889635 3.982142 -0.956951
C 1.391760 -2.571417 -0.517849
C 3.494351 -1.580941 0.209676
C 4.249314 -0.244741 0.170109
C 6.012576 0.970893 1.390341
C 6.597064 -1.008765 0.081630
H -2.646047 0.630131 2.234659
H -1.321376 -0.510646 1.866940
H -4.483588 -0.142045 -1.022630
H -4.607415 0.859467 0.459782
H -2.828352 -2.405855 1.805465
H -3.718475 -1.402987 2.970752
H -5.489982 -1.177401 1.363699
H -4.559430 -2.193052 0.242237
H -0.005882 0.964468 0.440002
H -3.852401 2.249722 -1.123782
H 0.969507 3.186448 -0.141171
H -2.874919 4.461427 -1.716267
H -0.487872 -3.156215 -1.455815
H 0.278747 -1.695604 -2.170611
H -0.459077 4.954273 -1.222740
H 1.906302 -3.394730 -1.064525
H 1.184984 -2.917276 0.518506
H 4.074417 -2.393911 -0.280898
H 3.307357 -1.873817 1.264418
H 3.621858 0.510147 0.677631
H 4.356654 0.081501 -0.893840
H 5.241725 1.408279 2.049019
H 6.244260 1.713722 0.584711
H 6.929841 0.826883 1.989810
H 7.505736 -1.132784 0.697564
H 6.261472 -2.014056 -0.225971
H 6.879030 -0.441720 -0.842556


