%chk=000209530.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209530

0 1
O -0.683247 2.692204 -1.329062
N 0.865719 0.832397 0.654796
C -0.608878 1.053074 0.522191
C -0.990386 2.493382 0.057529
C -1.300342 0.011606 -0.402692
C -0.317432 3.567885 0.923447
C 1.454769 1.870798 1.555148
C 1.180412 3.319812 1.120332
C 1.590664 0.740341 -0.654141
C -2.804334 0.079412 -0.196466
C -0.832593 -1.420385 -0.233868
C 3.022993 0.316740 -0.430870
C -3.409224 -0.491967 0.932463
C -0.937574 -2.283661 -1.338829
C -3.600470 0.731503 -1.151165
C -0.325909 -1.916131 0.975548
C 4.079875 1.112025 -0.894590
C 3.296068 -0.895282 0.222924
C -4.794221 -0.414033 1.101799
C -0.538289 -3.617416 -1.233034
C -4.984699 0.806777 -0.977906
C 0.075819 -3.251767 1.076153
C -5.584942 0.234833 0.148397
C -0.029420 -4.105701 -0.024961
C 5.401445 0.693325 -0.709015
C 4.617287 -1.306033 0.408397
C 5.672472 -0.513560 -0.058330
H -1.018185 0.921819 1.562956
H -2.099959 2.622894 0.059761
H -1.073532 0.327299 -1.461734
H -0.824950 3.614529 1.906503
H -0.477559 4.559082 0.453445
H 2.550184 1.691920 1.631111
H 1.043147 1.690948 2.572915
H 1.732151 3.548205 0.188877
H 1.581862 4.019562 1.877889
H 1.534735 1.686904 -1.244949
H 1.091617 -0.043544 -1.275540
H 0.292909 2.682914 -1.472802
H -2.801146 -1.010278 1.672909
H -1.340518 -1.916166 -2.280939
H -3.137347 1.187704 -2.026812
H -0.219566 -1.256982 1.836725
H 3.879525 2.053115 -1.400640
H 2.466254 -1.505243 0.587922
H -5.258166 -0.863694 1.977989
H -0.624464 -4.278514 -2.093436
H -5.596627 1.312333 -1.723096
H 0.471939 -3.626053 2.018316
H -6.662914 0.292639 0.281017
H 0.282198 -5.144250 0.056082
H 6.220470 1.310650 -1.073222
H 4.826830 -2.246177 0.915594
H 6.700947 -0.837294 0.084566


%chk=000209530-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209530

0 1
O -0.878627 2.857941 -1.238778
N 0.892553 1.001893 0.560724
C -0.597079 1.089290 0.524369
C -1.104470 2.529549 0.189595
C -1.260472 0.013730 -0.393412
C -0.462639 3.572358 1.134131
C 1.460627 1.964586 1.538945
C 1.077571 3.434135 1.218567
C 1.640667 0.917186 -0.713887
C -2.795000 0.067119 -0.250948
C -0.732322 -1.407072 -0.165161
C 3.041282 0.331247 -0.531208
C -3.466371 -0.560528 0.829573
C -0.693025 -2.308039 -1.259604
C -3.566289 0.775052 -1.208491
C -0.336181 -1.884788 1.110483
C 4.175028 0.988723 -1.067164
C 3.220090 -0.899823 0.150091
C -4.871417 -0.478302 0.952220
C -0.276561 -3.647568 -1.091088
C -4.972165 0.854718 -1.091427
C 0.077593 -3.224362 1.286749
C -5.631432 0.228377 -0.008628
C 0.108618 -4.113218 0.186932
C 5.467379 0.428250 -0.933220
C 4.508073 -1.460883 0.286416
C 5.637296 -0.799901 -0.255364
H -0.930909 0.894139 1.569022
H -2.202067 2.568915 0.287643
H -1.041624 0.303697 -1.439192
H -0.890567 3.425002 2.146933
H -0.757146 4.585648 0.802928
H 2.556943 1.835306 1.563380
H 1.074193 1.701622 2.545273
H 1.553584 3.745582 0.265272
H 1.478506 4.112400 1.995663
H 1.756693 1.901112 -1.240916
H 1.069608 0.266126 -1.398722
H 0.086318 3.033841 -1.375086
H -2.893841 -1.137357 1.564464
H -1.000693 -1.956973 -2.252994
H -3.053831 1.281913 -2.035112
H -0.323556 -1.203396 1.967772
H 4.047955 1.944056 -1.593175
H 2.342601 -1.403011 0.569399
H -5.374075 -0.973404 1.791228
H -0.252246 -4.324379 -1.952782
H -5.550412 1.405444 -1.842151
H 0.380486 -3.572872 2.281039
H -6.721978 0.286184 0.083223
H 0.432756 -5.151151 0.323081
H 6.336045 0.949151 -1.352234
H 4.633154 -2.415706 0.810213
H 6.636774 -1.237058 -0.148981


