%chk=000101573.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101573

0 1
 O   -1.757200      -1.444100     -0.4953000    
 O    3.759100      -2.822500      -1.703900    
 N   0.9891000      -1.136700      4.8799999E-02
 C   0.2603000      -2.322000      0.4975000    
 C   0.9626000     -9.9299997E-02   1.079400    
 C    2.368800      -1.482900     -0.2919000    
 C   -1.210000      -1.960800      0.7115000    
 C   0.8985000      -2.880000       1.769900    
 C    1.652800       1.159600      0.6260000    
 C    2.403000      -2.529800      -1.393900    
 C    3.011100       1.317600      0.8636000    
 C   0.9213000       2.144500     -2.2800000E-02
 C   -2.738900     -0.4963000     -0.3718000    
 C    3.650700       2.483900      0.4436000    
 C    1.560900       3.310800     -0.4427000    
 C    2.925700       3.480600     -0.2095000    
 C   -3.578600     -0.5153000      0.7361000    
 C   -2.885500      0.4752000      -1.355600    
 C   -4.577900      0.4497000      0.8619000    
 C   -3.884800       1.440200      -1.229800    
 C   -4.731100       1.427500     -0.1210000    
 H   0.2396000      -3.092900     -0.2774000    
 H  -5.3300001E-02  0.2035000       1.349900    
 H    1.445100     -0.4037000       2.015800    
 H    2.992600      -1.783300      0.5576000    
 H    2.883800     -0.6254000     -0.7383000    
 H   -1.760300      -2.880800      0.9507000    
 H   -1.331900      -1.298500       1.575600    
 H   0.7953000      -2.230900       2.644100    
 H   0.3723000      -3.805300       2.040000    
 H    1.945400      -3.171300       1.657400    
 H    1.969700      -3.487000      -1.099400    
 H    1.906500      -2.172200      -2.302400    
 H    3.587500      0.5584000       1.384600    
 H  -0.1414000       2.022800     -0.2117000    
 H    4.712600       2.617600      0.6283000    
 H   0.9963000       4.086600     -0.9516000    
 H    3.754200      -3.477100      -2.423000    
 H    3.423500       4.389000     -0.5359000    
 H   -3.520100      -1.279800       1.504600    
 H   -2.227400      0.4893000      -2.219800    
 H   -5.242800      0.4351000       1.720700    
 H   -4.003900       2.201500      -1.995100    
 H   -5.510300       2.177700     -2.4000000E-02


%chk=000101573-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101573

0 1
O -1.558314 -1.154344 -0.264043
O 2.815006 -2.411980 -2.732276
N 1.327889 -1.277278 0.499427
C 0.270878 -2.231687 0.909666
C 1.860064 -0.373499 1.534716
C 2.322332 -1.816289 -0.452040
C -1.090122 -1.532471 1.077874
C 0.614364 -3.064748 2.178340
C 2.317197 0.973811 0.972438
C 1.831352 -1.690323 -1.902637
C 3.493582 1.594715 1.457949
C 1.544075 1.641041 -0.011499
C -2.775166 -0.461631 -0.365634
C 3.889919 2.865257 0.978731
C 1.936246 2.910158 -0.490522
C 3.110347 3.528111 0.003635
C -3.596412 -0.112957 0.736602
C -3.163867 -0.111187 -1.683675
C -4.803186 0.588726 0.505711
C -4.368820 0.585984 -1.896153
C -5.197668 0.942209 -0.802869
H 0.149108 -2.938163 0.066479
H 1.051672 -0.186586 2.270318
H 2.702499 -0.824459 2.114436
H 2.562693 -2.885967 -0.255014
H 3.266134 -1.251680 -0.352447
H -1.822621 -2.223875 1.544529
H -0.999450 -0.628884 1.715520
H 0.634229 -2.439250 3.090149
H -0.123996 -3.872474 2.336533
H 1.609147 -3.532226 2.065437
H 0.819766 -2.135638 -2.004570
H 1.773040 -0.618358 -2.179002
H 4.104497 1.081367 2.211846
H 0.645814 1.143355 -0.395655
H 4.805119 3.332717 1.360013
H 1.328345 3.418902 -1.247799
H 2.587480 -2.294042 -3.687850
H 3.415848 4.511793 -0.370951
H -3.313741 -0.377712 1.759654
H -2.510895 -0.393692 -2.515495
H -5.435293 0.857787 1.359776
H -4.662737 0.853501 -2.917403
H -6.133456 1.485165 -0.971443


