%chk=000191246.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191246

0 1
O 0.491001 2.434628 -0.454749
O -4.529390 0.262005 -0.457584
N -1.276107 -0.860301 0.463170
N 1.560607 0.563024 0.253731
C 0.828467 -1.689745 -0.654075
C -0.269001 0.380114 -1.453062
C -1.593596 -0.021133 -0.747564
C 1.809454 -0.905310 0.259308
C 0.481890 -0.875376 -1.908440
C -0.469724 -2.071272 0.094432
C -2.382309 1.235395 -0.331011
C 0.611473 1.213744 -0.522132
C 3.276155 -1.172394 -0.162897
C -2.537380 -1.291353 1.156325
C -3.627772 0.890507 0.484784
C 2.478283 1.356600 1.116899
C -3.299528 -0.053647 1.649145
C 4.255359 -0.406521 0.736482
C 3.943053 1.095275 0.732387
H 1.325243 -2.643085 -0.959301
H -0.517981 1.024193 -2.332972
H -2.221088 -0.592905 -1.484341
H 1.669930 -1.255706 1.318979
H -0.135437 -1.468530 -2.607470
H 1.397248 -0.601795 -2.466197
H -1.041621 -2.794343 -0.528407
H -0.211702 -2.595531 1.040938
H -1.734290 1.923978 0.256012
H -2.677136 1.798203 -1.239559
H 3.425318 -0.870084 -1.217196
H 3.488949 -2.255292 -0.116620
H -2.254817 -1.923789 2.024929
H -3.200920 -1.898455 0.500630
H -4.136882 1.811276 0.850080
H 2.294789 1.085306 2.179306
H 2.230802 2.440766 1.007433
H -4.214883 -0.361796 2.182809
H -2.675618 0.492864 2.387738
H 5.292972 -0.577406 0.393021
H 4.206842 -0.799439 1.770346
H 4.611481 1.630878 1.431273
H 4.144941 1.519477 -0.271131
H -5.294778 -0.124325 -0.000846


%chk=000191246-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191246

0 1
O 0.480369 2.529168 -0.470210
O -4.575691 0.140260 -0.454878
N -1.268308 -0.866578 0.442711
N 1.624191 0.598591 0.154197
C 0.827900 -1.664398 -0.689043
C -0.272014 0.417022 -1.455634
C -1.592051 -0.000569 -0.733584
C 1.808244 -0.879040 0.225627
C 0.477993 -0.837421 -1.945029
C -0.479050 -2.054495 0.036206
C -2.422668 1.229007 -0.310650
C 0.628908 1.263581 -0.548253
C 3.290391 -1.222527 -0.091553
C -2.484663 -1.283927 1.189278
C -3.670695 0.843298 0.489240
C 2.516517 1.377060 1.044005
C -3.286923 -0.065064 1.675371
C 4.273258 -0.437705 0.807634
C 3.996862 1.081265 0.726858
H 1.333687 -2.604509 -0.984352
H -0.553813 1.072260 -2.299550
H -2.196417 -0.584495 -1.476367
H 1.608663 -1.173989 1.280975
H -0.166833 -1.429939 -2.622556
H 1.387554 -0.559081 -2.509386
H -1.073265 -2.722133 -0.644973
H -0.245691 -2.641417 0.946342
H -1.799557 1.910369 0.294479
H -2.728457 1.783327 -1.216196
H 3.491447 -0.992186 -1.157284
H 3.436411 -2.312012 0.044465
H -2.163333 -1.894737 2.054529
H -3.145795 -1.923739 0.550644
H -4.174638 1.760956 0.861127
H 2.296443 1.106671 2.099129
H 2.265888 2.440629 0.901215
H -4.193197 -0.404058 2.216722
H -2.671238 0.520837 2.384514
H 5.318144 -0.661306 0.520380
H 4.150156 -0.772195 1.859028
H 4.641979 1.632008 1.437962
H 4.229123 1.454603 -0.289340
H -5.397534 -0.124690 0.030802


