%chk=000099792.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099792

0 1
 N  -0.3242000     -0.8570000      0.3514000    
 N    3.273100      0.1053000      0.2502000    
 C   -2.263300     -0.4567000      -1.008500    
 C   -2.631500      -1.017100      0.3691000    
 C  -0.7284000     -0.5555000      -1.030300    
 C   -1.460000     -0.5523000       1.225700    
 C   -2.715300      0.9979000      -1.217300    
 C   -4.011100     -0.6248000      0.8907000    
 C   -4.163400       1.221400     -0.8045000    
 C   -4.370800      0.8365000      0.6545000    
 C   0.8933000     -0.1700000      0.7515000    
 C    2.055500     -0.5973000     -0.1398000    
 C    3.095600       1.552600      0.1222000    
 C    4.407300     -0.3412000     -0.5601000    
 C    4.333600       2.300700      0.5869000    
 C    4.609400      -1.842300     -0.4417000    
 H   -2.706100      -1.081900      -1.793600    
 H   -2.599100      -2.116300      0.3211000    
 H  -0.4158000      -1.380900      -1.679800    
 H  -0.2885000      0.3682000      -1.425500    
 H   -1.528700      0.5173000       1.457200    
 H   -1.401000      -1.111300       2.165200    
 H   -2.587700       1.269200      -2.272300    
 H   -2.078600       1.684700     -0.6444000    
 H   -4.091700     -0.8582000       1.958800    
 H   -4.759300      -1.245700      0.3804000    
 H   -4.829500      0.6322000      -1.446200    
 H   -4.427700       2.275200     -0.9475000    
 H   -3.762400       1.481100       1.299800    
 H   -5.416900       1.005200      0.9344000    
 H   0.6862000      0.9022000      0.7025000    
 H    1.128900     -0.4148000       1.795200    
 H    2.160100      -1.679500     -4.3000001E-03
 H    1.847600     -0.4192000      -1.202000    
 H    2.306400       1.922900      0.7800000    
 H    2.842400       1.848600     -0.9035000    
 H    5.337900      0.1111000     -0.2021000    
 H    4.290400     -6.7900002E-02  -1.616400    
 H    4.686000       1.939700       1.559400    
 H    5.154500       2.240300     -0.1342000    
 H    4.098700       3.365300      0.7007000    
 H    4.586600      -2.176500      0.6013000    
 H    3.873000      -2.411600      -1.017200    
 H    5.591800      -2.111300     -0.8465000    


%chk=000099792-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099792

0 1
N -0.348485 -0.717611 -0.123155
N 3.363837 0.157888 -0.071842
C -2.463593 -0.078964 -1.157115
C -2.683699 -1.099121 0.007528
C -0.921741 -0.123592 -1.374363
C -1.432621 -0.860201 0.881964
C -2.946154 1.349001 -0.783052
C -4.054067 -0.986367 0.715368
C -4.384164 1.358752 -0.217972
C -4.472752 0.467434 1.042108
C 0.908657 -0.126781 0.363835
C 2.110349 -0.491373 -0.535927
C 3.511979 1.546264 -0.585910
C 4.573502 -0.678042 -0.294253
C 4.379925 2.437347 0.323794
C 4.692397 -1.836210 0.714674
H -3.007577 -0.407572 -2.064208
H -2.587259 -2.120610 -0.412884
H -0.646090 -0.736618 -2.255050
H -0.525440 0.904472 -1.550742
H -1.560098 0.051628 1.517702
H -1.223190 -1.710582 1.558233
H -2.873000 2.001541 -1.675686
H -2.262146 1.780918 -0.023720
H -4.047939 -1.600846 1.638113
H -4.825933 -1.427841 0.051391
H -5.090894 0.979640 -0.986002
H -4.693583 2.395363 0.018850
H -3.815560 0.887155 1.830770
H -5.502288 0.473215 1.450181
H 0.836553 0.989369 0.455042
H 1.116330 -0.513999 1.378023
H 2.230772 -1.588628 -0.505260
H 1.881543 -0.229648 -1.598771
H 2.500522 1.989279 -0.648067
H 3.924115 1.553481 -1.628045
H 5.459915 -0.026523 -0.184229
H 4.606051 -1.081026 -1.339048
H 3.947328 2.473882 1.338781
H 5.414125 2.057353 0.409519
H 4.434451 3.466496 -0.078719
H 4.731012 -1.438620 1.743815
H 3.832069 -2.527088 0.650167
H 5.610143 -2.424317 0.524663


