%chk=000151249.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151249

0 1
 O    5.074900      0.1774000      0.9339000    
 O    4.046100       2.522600      -1.043300    
 O    2.402400       2.379600      0.5737000    
 N  -0.1988000      -2.194500      0.5933000    
 N   -2.321500      0.8713000      0.8189000    
 C    2.125000     -0.3688000      0.2575000    
 C    2.218600      -1.879100     -3.9600000E-02
 C  -0.3351000     -0.7276000      0.8023000    
 C   0.6847000      0.1008000     -6.2000002E-03
 C    3.161300      0.4046000     -0.5809000    
 C    1.182600      -2.649000      0.7932000    
 C    3.635300      -2.408600      0.2153000    
 C    4.591400     -0.1255000     -0.3760000    
 C    4.673700      -1.636500     -0.6014000    
 C   -1.732600     -0.3089000      0.4662000    
 C  -0.7696000      -2.654700     -0.6920000    
 C   -2.637600      -1.048400     -0.2631000    
 C   -2.295300      -2.407200     -0.7637000    
 C    3.136900       1.871900     -0.2629000    
 C   -3.831000     -0.2842000     -0.3681000    
 C   -3.605300      0.9157000      0.3166000    
 C   -1.794600       1.893000       1.698000    
 C   -5.086200     -0.4923000     -0.9741000    
 C   -4.576300       1.918600      0.4182000    
 C   -6.065100      0.5032000     -0.8791000    
 C   -5.811800       1.689400     -0.1938000    
 C    4.127700       3.937300     -0.8428000    
 H    2.340100     -0.2057000       1.323800    
 H    1.999600      -2.042100      -1.104300    
 H  -0.1664000     -0.5492000       1.872300    
 H   0.4686000      2.4900001E-02  -1.081000    
 H   0.5461000       1.154400      0.2422000    
 H    2.889100      0.2987000      -1.640300    
 H    1.254900      -3.724200      0.5860000    
 H    1.423800      -2.544300       1.859500    
 H    3.690700      -3.472100     -4.5699999E-02
 H    3.878100      -2.330700       1.282500    
 H    5.283200      0.3521000      -1.080500    
 H    5.672100      -2.000700     -0.3318000    
 H    4.521400      -1.852000      -1.666100    
 H  -0.6029000      -3.731800     -0.8163000    
 H  -0.2815000      -2.157500      -1.539200    
 H   -2.814200      -3.150300     -0.1456000    
 H   -2.638900      -2.535100      -1.796200    
 H    5.189200       1.140600      0.9949000    
 H   -1.586100       2.782500       1.098000    
 H   -2.534900       2.113200       2.471900    
 H  -0.8785000       1.548800       2.179800    
 H   -5.298500      -1.412000      -1.511900    
 H   -4.389200       2.846500      0.9484000    
 H   -7.034000      0.3476000      -1.346100    
 H   -6.586700       2.449300     -0.1330000    
 H    4.884000       4.334300      -1.525100    
 H    4.432100       4.156500      0.1851000    
 H    3.166800       4.408200      -1.070700    


%chk=000151249-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151249

0 1
O 5.080591 -0.142833 1.332043
O 2.838343 2.518068 -1.230337
O 3.803183 2.320643 0.872223
N -0.165653 -2.188959 0.442301
N -2.195229 0.978000 0.805081
C 2.266310 -0.463667 0.284698
C 2.333908 -1.979701 -0.046261
C -0.244759 -0.725786 0.727659
C 0.857585 0.090454 -0.033649
C 3.402582 0.290773 -0.479597
C 1.191308 -2.712455 0.713722
C 3.718423 -2.570698 0.298899
C 4.803893 -0.298206 -0.100150
C 4.859040 -1.804469 -0.406439
C -1.641293 -0.258622 0.406123
C -0.751603 -2.590415 -0.863071
C -2.574406 -0.977114 -0.338859
C -2.280958 -2.360103 -0.862208
C 3.378866 1.778273 -0.186903
C -3.769221 -0.165584 -0.426000
C -3.500764 1.056585 0.293326
C -1.559331 2.007284 1.625940
C -5.038561 -0.339031 -1.036402
C -4.458266 2.087822 0.407009
C -5.998569 0.687030 -0.924343
C -5.711581 1.887589 -0.210615
C 2.769732 3.989031 -1.023757
H 2.465586 -0.347144 1.372295
H 2.158139 -2.097640 -1.139183
H -0.044282 -0.609898 1.817305
H 0.661796 0.038255 -1.122827
H 0.786257 1.158875 0.248007
H 3.244918 0.157739 -1.566853
H 1.204665 -3.791189 0.466810
H 1.385571 -2.623942 1.804069
H 3.753905 -3.641404 0.016454
H 3.878609 -2.512025 1.392906
H 5.581863 0.233004 -0.693165
H 5.842839 -2.184523 -0.075389
H 4.798780 -1.947246 -1.504103
H -0.529735 -3.663549 -1.009731
H -0.308202 -2.039230 -1.729115
H -2.764702 -3.125288 -0.222801
H -2.674768 -2.495540 -1.889303
H 4.882881 0.805447 1.575569
H -1.155132 2.837333 1.013461
H -2.292139 2.425120 2.338840
H -0.733445 1.568982 2.209085
H -5.271106 -1.258624 -1.585757
H -4.245989 3.017496 0.946710
H -6.982404 0.565200 -1.391573
H -6.477144 2.668852 -0.142488
H 2.309466 4.377357 -1.942367
H 3.783022 4.398441 -0.878454
H 2.154980 4.221230 -0.138134


