%chk=000119593.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000119593

0 1
 O   0.7551000       2.355900      -1.051800    
 O   0.3288000       4.559300      -1.377400    
 O    2.771500      0.9913000       1.149100    
 O    4.247800     -0.2254000       2.365700    
 N   -3.452400     -0.9148000     -0.1024000    
 N   0.9415000      -1.941700      -1.731300    
 N   -1.273600      -1.137400      -1.236600    
 N  -0.3632000      -2.798200      4.9400002E-02
 N  -0.3365000       4.779900       1.302900    
 N    5.747800     -0.8534000      0.1923000    
 C   -3.739300       1.501600     -0.3970000    
 C   -2.253100       1.844300     -0.2274000    
 C   -4.014800      0.1058000     -0.9518000    
 C   -1.993200       3.194000      0.4498000    
 C  -0.4987000       3.480600      0.6452000    
 C   -2.174500      -1.428800     -0.3393000    
 C    3.039500      -2.142300     -0.5033000    
 C    3.588900     -0.8054000      -1.026700    
 C    2.063600      -2.794100      -1.481900    
 C   -1.610800      -2.503400      0.5026000    
 C   -4.171700      -1.489900      0.9545000    
 C    4.531800     -7.9400003E-02 -5.5000000E-02
 C  -0.1942000      -1.984900     -0.9684000    
 C   -2.350300      -2.994300       1.502700    
 C   -3.688000      -2.471000       1.739200    
 C   0.2308000       3.554000     -0.6849000    
 C    3.867300      0.1976000       1.281800    
 H   -4.202200       2.243000      -1.059800    
 H   -4.235700       1.602100      0.5768000    
 H   -1.761800       1.083200      0.3865000    
 H   -1.787000       1.820200      -1.218300    
 H   -5.098700     -3.3500001E-02  -1.053100    
 H   -3.609500      2.9300001E-02  -1.968400    
 H   -2.451900       3.983900     -0.1599000    
 H   -2.500100       3.207600       1.423300    
 H  -3.0999999E-02   2.712700       1.271800    
 H    3.863500      -2.842700     -0.3272000    
 H    2.535600      -1.990100      0.4583000    
 H    4.110800     -0.9788000      -1.976900    
 H    2.754200     -0.1316000      -1.255700    
 H    2.579200      -2.982500      -2.431000    
 H    1.751500      -3.775500      -1.106500    
 H   -5.162700      -1.075700       1.099200    
 H    4.830600      0.8856000     -0.4798000    
 H    1.004700      -1.280400      -2.499700    
 H   -1.985400      -3.784400       2.148500    
 H   -4.273300      -2.889400       2.549300    
 H   0.6495000       4.936500       1.509800    
 H  -0.8159000       4.769200       2.202500    
 H    5.518000      -1.744000      0.6305000    
 H    6.193000      -1.082900     -0.6955000    
 H    1.214300       2.406500      -1.917100    
 H    2.341600       1.169200       2.012700    


%chk=000119593-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000119593

0 1
O 0.582812 1.931117 1.555732
O 1.275700 2.777704 -0.494855
O 2.493444 0.073926 1.898045
O 4.463285 -1.125568 2.073244
N -3.285242 -0.977644 -0.014821
N 0.783555 -2.134937 -2.188301
N -1.353053 -1.314560 -1.488040
N -0.156500 -2.791474 -0.048174
N -0.348253 5.159230 0.294021
N 5.436517 -0.070587 -0.290484
C -3.696946 1.480265 -0.512889
C -2.237982 1.803260 -0.105587
C -3.915309 0.007411 -0.942293
C -1.924339 3.315287 -0.193386
C -0.701459 3.773844 0.650830
C -2.069548 -1.526523 -0.352208
C 2.932936 -2.085183 -0.857499
C 3.015189 -0.552776 -1.006426
C 2.096069 -2.761867 -1.974411
C -1.361852 -2.439921 0.556576
C -3.859126 -1.309820 1.207280
C 4.016382 0.142158 -0.009413
C -0.208261 -2.103842 -1.245046
C -1.951788 -2.771674 1.783475
C -3.221441 -2.188550 2.089010
C 0.480277 2.794611 0.481218
C 3.744694 -0.366454 1.396657
H -3.996276 2.107708 -1.376827
H -4.380043 1.746486 0.318399
H -2.058110 1.439869 0.924524
H -1.540692 1.243284 -0.757065
H -4.993469 -0.225251 -1.013783
H -3.447264 -0.167622 -1.925204
H -1.743142 3.590217 -1.252174
H -2.784004 3.921076 0.151089
H -0.984268 3.742475 1.717449
H 3.948207 -2.531162 -0.867702
H 2.465500 -2.344201 0.110859
H 3.352725 -0.273631 -2.025605
H 2.014764 -0.103083 -0.871536
H 2.636474 -2.718229 -2.938464
H 1.950541 -3.826680 -1.713386
H -4.825186 -0.848714 1.423312
H 3.776331 1.224691 -0.032066
H 0.629268 -1.540633 -3.002384
H -1.462535 -3.452292 2.486320
H -3.722467 -2.422978 3.032114
H 0.295868 5.603047 0.958712
H 0.007312 5.231619 -0.667673
H 5.871532 -0.863698 0.184349
H 5.724508 0.079711 -1.256792
H 1.349328 1.270771 1.477510
H 2.316734 -0.362814 2.774069


