%chk=000205549.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205549

0 1
N 3.427678 1.233156 -0.196312
N -0.237410 0.186097 1.801227
C 3.067460 -0.222545 -0.113565
C 4.294841 -1.134989 0.132275
C 1.984810 -0.491006 0.951023
C 5.357555 -0.915767 -0.952030
C 4.472544 1.438038 -1.247417
C 5.730771 0.567132 -1.075635
C 0.675356 0.243764 0.616658
C 3.852168 1.822080 1.107341
C -0.869445 -1.148273 2.008168
C -1.193378 1.330402 1.842062
C -1.447068 -1.854186 0.801608
C -1.897849 1.699574 0.555962
C -2.675578 -1.477830 0.228208
C -2.982582 0.955808 0.057108
C -3.458277 -0.298118 0.744660
C -0.744644 -2.942644 0.259877
C -1.469342 2.839351 -0.143060
C -3.181514 -2.197224 -0.866882
C -3.625941 1.368604 -1.121067
C -1.251941 -3.653132 -0.829403
C -2.111276 3.243406 -1.314919
C -2.475957 -3.280247 -1.393067
C -3.195272 2.507354 -1.803340
H 2.636786 -0.474773 -1.121560
H 3.982467 -2.194089 0.144958
H 4.723665 -0.931806 1.130580
H 2.334431 -0.187959 1.957735
H 1.800480 -1.579730 1.015519
H 4.982438 -1.289329 -1.924638
H 6.258804 -1.514154 -0.722556
H 4.749241 2.512506 -1.267802
H 3.991928 1.221631 -2.227294
H 6.291685 0.889756 -0.178498
H 6.412284 0.718715 -1.931907
H 0.216708 -0.178037 -0.303307
H 0.900874 1.311569 0.388253
H 4.737394 1.352578 1.559513
H 3.016230 1.746671 1.823469
H 4.061405 2.893453 0.965437
H -1.654633 -1.054997 2.793530
H -0.072300 -1.782345 2.468496
H -0.593761 2.200747 2.207299
H -1.947896 1.141809 2.639880
H -4.546048 -0.446804 0.578819
H -3.356369 -0.207792 1.847721
H 0.210482 -3.237242 0.693177
H -0.621862 3.414769 0.229555
H -4.129175 -1.903414 -1.314510
H -4.462731 0.791824 -1.510235
H -0.696014 -4.493731 -1.238648
H -1.766896 4.127405 -1.847359
H -2.876561 -3.830757 -2.241859
H -3.699768 2.819026 -2.715650


%chk=000205549-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000205549

0 1
N 3.601186 1.227036 -0.047720
N -0.215347 0.215730 1.583548
C 3.212944 -0.216886 -0.151933
C 4.431849 -1.169110 0.034932
C 2.040096 -0.580097 0.785217
C 5.554782 -0.827666 -0.977217
C 4.658371 1.551210 -1.042038
C 5.932948 0.672529 -0.906484
C 0.775399 0.257400 0.488449
C 3.900948 1.716230 1.314863
C -0.785722 -1.110075 1.916554
C -1.102110 1.400977 1.668425
C -1.502322 -1.889384 0.800518
C -1.949028 1.756988 0.436566
C -2.785956 -1.511300 0.304118
C -3.095218 0.998128 0.053811
C -3.512619 -0.263757 0.811931
C -0.875568 -3.041712 0.261205
C -1.589294 2.889047 -0.337309
C -3.393585 -2.295787 -0.707119
C -3.844560 1.401868 -1.078454
C -1.483194 -3.812256 -0.754714
C -2.335354 3.278627 -1.471686
C -2.754279 -3.436183 -1.241747
C -3.474847 2.531053 -1.842379
H 2.856985 -0.347346 -1.199132
H 4.103946 -2.219337 -0.097863
H 4.816130 -1.082757 1.072005
H 2.326540 -0.438092 1.845508
H 1.832803 -1.659942 0.652851
H 5.196830 -1.060814 -2.002478
H 6.444081 -1.462341 -0.798610
H 4.911582 2.624289 -0.947881
H 4.225844 1.401621 -2.053058
H 6.434383 0.887096 0.058772
H 6.652764 0.929364 -1.708442
H 0.346722 -0.064851 -0.490458
H 1.090191 1.309864 0.357956
H 4.722885 1.178370 1.846505
H 2.998241 1.653518 1.947577
H 4.188044 2.781604 1.249613
H -1.471343 -0.961102 2.773500
H 0.039359 -1.747057 2.289749
H -0.457455 2.274590 1.892425
H -1.757305 1.257551 2.550043
H -4.600877 -0.411303 0.686012
H -3.331162 -0.134153 1.894794
H 0.102951 -3.344358 0.656557
H -0.709936 3.475026 -0.040197
H -4.385423 -2.008669 -1.078378
H -4.732084 0.823134 -1.363870
H -0.975358 -4.697198 -1.154485
H -2.034340 4.156527 -2.054365
H -3.245193 -4.025964 -2.024056
H -4.070330 2.824424 -2.714334


